COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL286826
Chemical Name: {3-[(4-chlorophenyl)sulfonyl]phenyl}[(7Z)-7-(4-nitrobenzylidene)-3-(4-nitrophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
Smiles: Clc1ccc(cc1)S(=O)(=O)c1cccc(c1)C(=O)N1N=C2C(C1c1ccc(cc1)[N+](=O)[O-])CCC/C/2=C/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 657.1
Empirical Formula: C33H25ClN4O7S

Physical State: Dry powder
Available Amount: 41 mg

Lipinsky:
logP: 6.45
Rotatable bonds: 2
H-donors: 0
H-acceptors: 7
PSA: 166
Number of rings: 6

     

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