COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK303011
Chemical Name: ethyl2-[({[5-(4-chloro-1,3-dimethyl-1H-pyrazol-5-yl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(n2CC(C)C)c2n(C)nc(c2Cl)C)sc(c1C)C

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Molecular Weight: 525.1
Empirical Formula: C22H29ClN6O3S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.015
Rotatable bonds: 9
H-donors: 1
H-acceptors: 3
PSA: 157
Number of rings: 3

     

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