COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK133948
Chemical Name: methyl2-[({[5-({[(2-fluorophenyl)carbonyl]amino}methyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C(=O)OC)nnc1CNC(=O)c1ccccc1F

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Molecular Weight: 483.52
Empirical Formula: C23H22FN5O4S

Physical State: Dry powder
Available Amount: 216 mg

Lipinsky:
logP: 3.528
Rotatable bonds: 10
H-donors: 2
H-acceptors: 4
PSA: 140
Number of rings: 3

     

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