COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505866
Chemical Name: N-cyclohexyl-2-{[(Z)-(2-hydroxy-3,5-dinitrophenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(c1c(/N=C\c2cc(cc(c2O)[N+](=O)[O-])[N+](=O)[O-])sc2c1CCCC2)NC1CCCCC1

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Molecular Weight: 472.52
Empirical Formula: C22H24N4O6S

Physical State: Dry powder
Available Amount: 491 mg

Lipinsky:
logP: 6.667
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 181
Number of rings: 4

     

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