COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK016693
Chemical Name: (4-{(E)-[5-imino-2-(3-methylphenyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}-2-methoxyphenoxy)aceticacid
Smiles: COc1cc(ccc1OCC(=O)O)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)c1cccc(c1)C

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Molecular Weight: 450.47
Empirical Formula: C22H18N4O5S

Physical State: Dry powder
Available Amount: 113 mg

Lipinsky:
logP: 2.091
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 149
Number of rings: 4

     

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