COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK302831
Chemical Name: methyl2-[({[5-(4-bromo-1,5-dimethyl-1H-pyrazol-3-yl)-4-(4-fluorophenyl)-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(n2c2ccc(cc2)F)c2nn(c(c2Br)C)C)sc2c1CCCC2

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Molecular Weight: 619.54
Empirical Formula: C25H24BrFN6O3S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.257
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 157
Number of rings: 5

     

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