COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK302871
Chemical Name: ethyl2-[({[5-(4-chloro-1-methyl-1H-pyrazol-3-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc(n2Cc2ccco2)c2nn(cc2Cl)C)sc(c1C)C

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Molecular Weight: 535.05
Empirical Formula: C22H23ClN6O4S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.083
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 170
Number of rings: 4

     

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