COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL400158
Chemical Name: propan-2-yl2-{[(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CC(OC(=O)c1c(sc2c1CCCC2)NC(=O)c1n(C)nc(c1[N+](=O)[O-])C)C

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Molecular Weight: 406.46
Empirical Formula: C18H22N4O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.944
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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