COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK218488
Chemical Name: N-{2-hydroxy-1-[5-({2-[(4-methyl-3-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}-4-methoxybenzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])C)nnc1C(NC(=O)c1ccc(cc1)OC)CO

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Molecular Weight: 526.57
Empirical Formula: C24H26N6O6S

Physical State: Dry powder
Available Amount: 273 mg

Lipinsky:
logP: 4.517
Rotatable bonds: 9
H-donors: 3
H-acceptors: 6
PSA: 189
Number of rings: 3

     

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