COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK631110
Chemical Name: (4Z)-4-(3,4-dihydroisoquinolin-2(1H)-ylmethylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C\N1CCc2c(C1)cccc2)c1ccccc1

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Molecular Weight: 317.39
Empirical Formula: C20H19N3O

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.363
Rotatable bonds: 0
H-donors: 0
H-acceptors: 1
PSA: 35
Number of rings: 4

     

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