COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK218948
Chemical Name: propan-2-yl4-chloro-3-[({[5-(4-methoxybenzyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: C=CCn1c(SCC(=O)Nc2cc(ccc2Cl)C(=O)OC(C)C)nnc1Cc1ccc(cc1)OC

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Molecular Weight: 515.03
Empirical Formula: C25H27ClN4O4S

Physical State: Dry powder
Available Amount: 37 mg

Lipinsky:
logP: 5.637
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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