COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK143092
Chemical Name: 1-cyclohexyl-1-{3-[(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)amino]propyl}-3-phenylthiourea
Smiles: O=C1C=C(NCCCN(C(=S)Nc2ccccc2)C2CCCCC2)CC(C1)(C)C

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Molecular Weight: 413.63
Empirical Formula: C24H35N3OS

Physical State: Dry powder
Available Amount: 468 mg

Lipinsky:
logP: 4.645
Rotatable bonds: 5
H-donors: 2
H-acceptors: 1
PSA: 76
Number of rings: 3

     

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