COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK140052
Chemical Name: methyl3-[({[5-(1-{[(2,4-dichlorophenyl)carbonyl]amino}-3-methylbutyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1cccc(c1)NC(=O)CSc1nnc(n1C)C(NC(=O)c1ccc(cc1Cl)Cl)CC(C)C

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Molecular Weight: 564.49
Empirical Formula: C25H27Cl2N5O4S

Physical State: Dry powder
Available Amount: 27 mg

Lipinsky:
logP: 5.549
Rotatable bonds: 10
H-donors: 2
H-acceptors: 4
PSA: 140
Number of rings: 3

     

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