COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK117648
Chemical Name: 4-chloro-N-({4-ethyl-5-[(2-{[3-(methylsulfanyl)phenyl]amino}-2-oxoethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)benzamide
Smiles: CSc1cccc(c1)NC(=O)CSc1nnc(n1CC)CNC(=O)c1ccc(cc1)Cl

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Molecular Weight: 476.02
Empirical Formula: C21H22ClN5O2S2

Physical State: Dry powder
Available Amount: 198 mg

Lipinsky:
logP: 4.816
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 139
Number of rings: 3

     

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