COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK889264
Chemical Name: {(7E)-7-[4-(dimethylamino)benzylidene]-3-[4-(dimethylamino)phenyl]-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl}(4-nitrophenyl)methanone
Smiles: CN(c1ccc(cc1)C1N(N=C2C1CCC/C/2=C\c1ccc(cc1)N(C)C)C(=O)c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 523.63
Empirical Formula: C31H33N5O3

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 6.034
Rotatable bonds: 0
H-donors: 0
H-acceptors: 3
PSA: 84
Number of rings: 5

     

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