COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186726
Chemical Name: 2-fluoro-N-{2-[5-({2-[(4-methyl-3-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])C)nnc1CCNC(=O)c1ccccc1F

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Molecular Weight: 498.54
Empirical Formula: C23H23FN6O4S

Physical State: Dry powder
Available Amount: 21 mg

Lipinsky:
logP: 3.937
Rotatable bonds: 9
H-donors: 2
H-acceptors: 4
PSA: 160
Number of rings: 3

     

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