COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK915052
Chemical Name: ethyl2-[({3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cccc(c2)Cn2cc(c(n2)[N+](=O)[O-])Cl)sc2c1CCCCC2

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Molecular Weight: 502.98
Empirical Formula: C23H23ClN4O5S

Available Amount: 0 mg

Lipinsky:
logP: 7.011
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 4

     

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