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To have your blog items show up on this page, use the semantic markup for InChI's and SMILES, using microformats or RDFa. For example, write <span class="chem:smiles">CCCOC<span> instead of just CCCOC, or <span class="chem:inchi">InChI=1/bla<span> instead of InChI=1/bla.

vx-809
InChI=1S/C24H18F2N2O5/c1-13-5-8-19(27-20(13)14-3-2-4-15(11-14)21(29)30)28-22(31)23(9-10-23)16-6-7-17-18(12-16)33-24(25,26)32-17h2-8,11-12H,9-10H2,1H3,(H,29,30)(H,27,28,31)
PubChem: 16678941
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Posts

   ATC code R07AX02 Wikipedia Ivacaftor On January 31st, FDA approved Ivacaftor (previously known as VX-770, trade name Kalydeco) as a first-in-class oral drug for the treatment of a rare form of Cystic Fibrosis in patients aged 6 or older, caused...
international chemical identifier
InChI=1/C2H6O/c1-2-3/h3H,2H2,1H3
PubChem: -1
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Posts

Unichem is a simple database and web service for the InChI-based linkage of chemical structures across various resources. It was initially developed under the EU-OPENSCREEN ESFRI as an approach to link screening data from the planned screening collection to...
Lately, I’ve been very interested in using my university’s Learning Management System (we use Moodle, others use Blackboard or something else) to administer quizzes to my students, but as an organic chemist, I’ve been hesitant to do so. Primarily...
Here at ChEMBL, we are often contacted by users who are interested in purchasing some of the compounds that we store in our databases. However, our compounds are curated directly from the literature and we do not have access to physical samples. To enable our...
Its a simple and increasingly common question: how can I enable users to search my website by chemical structure? Text search can be done relatively easily, but chemical exact structure and substructure search are considerably more complex. This article offers...
The mcule project was started in last June with very ambitious goals. Several months have passed and you could ask whats happening behind the scenes? And when can I finally start searching/screening/ordering etc. Well, a lot of things happened since last June.Laying...
Developing a molecule database is not a trivial task. There are several problems you have to deal with and they can be handled differently depending on the size, content and purpose of the database. Here I try to provide a list of the most common issues we...
We are pleased to announce that we have updated the ChEMBL RESTful Web Service API (application programming interface) with some more of the features that you the ChEMBL users requested. In particular, we have added support for the: Retrieval of results in...
axitinib
InChI=1S/C22H18N4OS/c1-23-22(27)18-7-2-3-8-21(18)28-16-10-11-17-19(25-26-20(17)14-16)12-9-15-6-4-5-13-24-15/h2-14H,1H3,(H,23,27)(H,25,26)/b12-9+
PubChem: 6450551
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Posts

ATC Code: L01XE17Wikipedia: Axitinib On Jan 27th 2012, the FDA approved Axitinib (also known as AG-13736, trade name: Inlyta), a kinase inhibitor, for the treatment of advanced renal cell carcinoma after failure of a first line systemic treatment. Renal Cell...
methotrexate
InChI=1S/C20H22N8O5/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27)/t13-/m0/s1
PubChem: 126941
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Posts

ATC code: V03AF09The first FDA new drug approval of 2012 is Glucarpidase, approved on Jan 17th 2012. Glucarpidase (tradename: Voraxaze; formerly known as carboxypeptidase-G2 or CPG2) is a carboxypeptidase enzyme indicated for the treatment of toxic plasma methotrexate...
denatonium
InChI=1S/C21H28N2O.C7H6O2/c1-5-23(6-2,15-19-13-8-7-9-14-19)16-20(24)22-21-17(3)11-10-12-18(21)4;8-7(9)6-4-2-1-3-5-6/h7-14H,5-6,15-16H2,1-4H3;1-5H,(H,8,9)
PubChem: 19518
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Chemical health and safety news from the past week:Things we’re followingThe case against UCLA and Patrick Harran in Sheharbano (Sheri) Sangji’s death: UCLA was scheduled to be arraigned on Thursday, but the case was continued to Feb. 2, the same...
calcium hydroxide
InChI=1S/Ca.2H2O/h;2*1H2/q+2;;/p-2
PubChem: 14777
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Cloning popular brands of mineral water is now simpler then ever before with the updated version of the mineral water calculator!When I blogged about DIY mineral water last year it was mainly a theoretical exercise since I didn’t have the required salts...
milk of magnesia
InChI=1S/Mg.2H2O/h;2*1H2/q+2;;/p-2
PubChem: 14791
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Cloning popular brands of mineral water is now simpler then ever before with the updated version of the mineral water calculator!When I blogged about DIY mineral water last year it was mainly a theoretical exercise since I didn’t have the required salts...
baking soda
InChI=1S/CH2O3.Na/c2-1(3)4;/h(H2,2,3,4);/q;+1/p-1
PubChem: 516892
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I've had these two boxes as staples in my baking supplies forever as do most of homes. We follow the instructions to use one or the other (or both) in our recipes but do we know why?I knew that baking soda makes great volcanoes when mixed with vinegar but why...
Cloning popular brands of mineral water is now simpler then ever before with the updated version of the mineral water calculator!When I blogged about DIY mineral water last year it was mainly a theoretical exercise since I didn’t have the required salts...
epsom salt
InChI=1S/Mg.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2
PubChem: 24083
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Posts

Cloning popular brands of mineral water is now simpler then ever before with the updated version of the mineral water calculator!When I blogged about DIY mineral water last year it was mainly a theoretical exercise since I didn’t have the required salts...
ruxolitinib
InChI=1S/C17H18N6/c18-7-5-15(12-3-1-2-4-12)23-10-13(9-22-23)16-14-6-8-19-17(14)21-11-20-16/h6,8-12,15H,1-5H2,(H,19,20,21)/t15-/m1/s1-N
PubChem: 5359967
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Posts

ATC Code: L01XE18 Wikipedia:Ruxolitinib On November 16th 2011, the FDA approved ruxolitinib (Tradename:Jakafi Research Code: INCB-018424), a JAK1/JAK2 inhibitor for the treatment of patients with intermediate or high-risk myelofibrosis, including primary myelofibrosis,...