COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK017673
Chemical Name: methyl2-[({3-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)c2cccc(c2)Cn2nc(c(c2C)Cl)C)sc(c1C)C

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Molecular Weight: 431.94
Empirical Formula: C21H22ClN3O3S

Physical State: Dry powder
Available Amount: 44 mg

Lipinsky:
logP: 6.378
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 101
Number of rings: 3

     

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