COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK250240
Chemical Name: 5,5-dimethyl-3-{[3-(4-methylphenyl)-1H-pyrazol-5-yl]amino}cyclohex-2-en-1-one
Smiles: O=C1C=C(Nc2[nH]nc(c2)c2ccc(cc2)C)CC(C1)(C)C

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Molecular Weight: 295.38
Empirical Formula: C18H21N3O

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 3.723
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 57
Number of rings: 3

     

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