COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK993709
Chemical Name: (7Z)-7-(4-methoxybenzylidene)-3-(4-methoxyphenyl)-5-methyl-2-(4-nitrophenyl)-3,3a,4,5,6,7-hexahydro-2H-pyrazolo[4,3-c]pyridin-5-ium
Smiles: COc1ccc(cc1)/C=C\1/C[NH+](C)CC2C1=NN(C2c1ccc(cc1)OC)c1ccc(cc1)[N+](=O)[O-]

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Saltdata: Cl-
Molecular Weight: 485.56
Empirical Formula: C28H29N4O4

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 4.732
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 84
Number of rings: 5

     

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