COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK306557
Chemical Name: methyl2-{[(4-nitro-1H-pyrazol-3-yl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCCC2)NC(=O)c1n[nH]cc1[N+](=O)[O-]

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Molecular Weight: 364.38
Empirical Formula: C15H16N4O5S

Physical State: Dry powder
Available Amount: 41 mg

Lipinsky:
logP: 5.045
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 158
Number of rings: 3

     

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