COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK289056
Chemical Name: N-{[5-({2-[(4-methyl-3-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}furan-2-carboxamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])C)nnc1CNC(=O)c1ccco1

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Molecular Weight: 456.48
Empirical Formula: C20H20N6O5S

Physical State: Dry powder
Available Amount: 142 mg

Lipinsky:
logP: 3.436
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 173
Number of rings: 3

     

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