COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK328654
Chemical Name: 3-[({[5-(2-chlorobenzyl)-4-hydroxy-6-methylpyrimidin-2-yl]sulfanyl}acetyl)amino]-5-nitrobenzoicacid
Smiles: O=C(Nc1cc(cc(c1)C(=O)O)[N+](=O)[O-])CSc1nc(C)c(c(n1)O)Cc1ccccc1Cl

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Molecular Weight: 488.91
Empirical Formula: C21H17ClN4O6S

Physical State: Dry powder
Available Amount: 11 mg

Lipinsky:
logP: 5.091
Rotatable bonds: 8
H-donors: 3
H-acceptors: 6
PSA: 183
Number of rings: 3

     

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