COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK302893
Chemical Name: methyl2-[({[5-(4-chloro-1-methyl-1H-pyrazol-3-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CSc2nnc(n2c2cccc(c2)C)c2nn(cc2Cl)C)sc2c1CCCC2

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Molecular Weight: 557.1
Empirical Formula: C25H25ClN6O3S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.029
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 157
Number of rings: 5

     

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