COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK955804
Chemical Name: methyl2-{[(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCCC2)NC(=O)c1n(C)nc(c1[N+](=O)[O-])C

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Molecular Weight: 392.44
Empirical Formula: C17H20N4O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.629
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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