COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK330250
Chemical Name: (4E)-4-(1H-indol-3-ylmethylidene)-5-methyl-2-(2-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/c1c[nH]c2c1cccc2)c1ccccc1C

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Molecular Weight: 315.37
Empirical Formula: C20H17N3O

Physical State: Dry powder
Available Amount: 242 mg

Lipinsky:
logP: 3.697
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 48
Number of rings: 4

     

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