COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675503
Chemical Name: (4Z)-4-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1NN=C(/C/1=C\1/NC(C)(C)Cc2c1cccc2)C

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Molecular Weight: 255.32
Empirical Formula: C15H17N3O

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 1.616
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 53
Number of rings: 3

     

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