COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK305110
Chemical Name: ethyl2-[({[5-(4-chloro-1,3-dimethyl-1H-pyrazol-5-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(n2Cc2ccco2)c2n(C)nc(c2Cl)C)sc2c1CCC(C2)C

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Molecular Weight: 589.14
Empirical Formula: C26H29ClN6O4S2

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 6.8
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 170
Number of rings: 5

     

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