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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.

InChI=1S/C22H30N6O4S.C6H8O7/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28;7-3(8)1-6(13,5(11)12)2-4(9)10/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29);13H,1-2H2,(H,7,8)(H,9,

Posts

Everyone's favorite free encyclopedia - wikipedia, has started to get links to ChEMBL added. The links are all sorted out, now we just need a bot to go round and sort everything out for a large set of compounds. So, to give you some idea of how it will look,...
Ah, sildenafil. What more is there to say? It has saved marriages. Broken up marriages. Provided fodder for terrible comedians. Made spam just that much more intolerable.It works as follows. You swallow a pill, which breaks down in your stomach and intestine,...
A reminder of an on campus, open, seminar from Andy Bell (now at Imperial College), detailing the discovery and development of UK-92,480 (also known as sildenafil and even better known as V1agra and R3vat10). Andy was one of the medicinal chemists...
lorcaserin
InChI=1S/C11H14ClN/c1-8-7-13-5-4-9-2-3-10(12)6-11(8)9/h2-3,6,8,13H,4-5,7H2,1H3/t8-/m0/s1
PubChem: 11658860
[CML][RDF]

Posts

ATC Code: A08A (incomplete)Wikipedia: Lorcaserin On June 27th, the FDA approved Lorcaserin hydrochloride (Tradename: BelviqTM; Research Code: APD-356), a selective serotonin 2C receptor (5HT2c) agonist, for chronic weight management in adults with an initial...
serotonin
InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
PubChem: 5202
[CML][RDF]

Posts

ATC Code: A08A (incomplete)Wikipedia: Lorcaserin On June 27th, the FDA approved Lorcaserin hydrochloride (Tradename: BelviqTM; Research Code: APD-356), a selective serotonin 2C receptor (5HT2c) agonist, for chronic weight management in adults with an initial...
dexfenfluramine
InChI=1S/C12H16F3N/c1-3-16-9(2)7-10-5-4-6-11(8-10)12(13,14)15/h4-6,8-9,16H,3,7H2,1-2H3/t9-/m0/s1
PubChem: 66265
[CML][RDF]

Posts

ATC Code: A08A (incomplete)Wikipedia: Lorcaserin On June 27th, the FDA approved Lorcaserin hydrochloride (Tradename: BelviqTM; Research Code: APD-356), a selective serotonin 2C receptor (5HT2c) agonist, for chronic weight management in adults with an initial...
armodafinil
InChI=1S/C15H15NO2S/c16-14(17)11-19(18)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,16,17)/t19-/m1/s1
PubChem: 9690109
[CML][RDF]

Posts

So some very sad news yesterday - the announcement of the closure of the Nutley R&D facilities of Roche. Families disrupted, kids moved to new schools, partners careers affected, and then inevitable greater competition for the few remaining jobs and downward...
phenoxymethylpenicillin
InChI=1S/C16H18N2O5S/c1-16(2)12(15(21)22)18-13(20)11(14(18)24-16)17-10(19)8-23-9-6-4-3-5-7-9/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t11-,12+,14-/m1/s1
PubChem: 6869
[CML][RDF]

Posts

Drug informatics can seem somewhat abstract until it translates to direct experience.  Spending ~ 20 hours zonked out with a bacterial infection forcibly brings this home.  This was my second encounter with septicemia the first being some years ago,...
InChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3/t18-,

Posts

Drug informatics can seem somewhat abstract until it translates to direct experience.  Spending ~ 20 hours zonked out with a bacterial infection forcibly brings this home.  This was my second encounter with septicemia the first being some years ago,...
potassium clavulanate
InChI=1S/C8H9NO5/c10-2-1-4-7(8(12)13)9-5(11)3-6(9)14-4/h1,6-7,10H,2-3H2,(H,12,13)/b4-1-/t6-,7-/m1/s1
PubChem: 5280980
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Posts

Drug informatics can seem somewhat abstract until it translates to direct experience.  Spending ~ 20 hours zonked out with a bacterial infection forcibly brings this home.  This was my second encounter with septicemia the first being some years ago,...
carbon dioxide
InChI=1S/CO2/c2-1-3
PubChem: 280
[CML][RDF]

Posts

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...
Bissan and I just had a really good breakfast discussion on drugs, and it prompted me to do a picture for the blog. There'll be some more, depending on collecting glasses from the opticians, getting some ivermectin for the tick infections that have appeared...
carbon monoxide
InChI=1S/CO/c1-2
PubChem: 281
[CML][RDF]

Posts

Bissan and I just had a really good breakfast discussion on drugs, and it prompted me to do a picture for the blog. There'll be some more, depending on collecting glasses from the opticians, getting some ivermectin for the tick infections that have appeared...