COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK207340
Chemical Name: 5-(4-tert-butylphenyl)-3-{[2-(1H-imidazol-4-yl)ethyl]amino}cyclohex-2-en-1-one
Smiles: O=C1C=C(NCCc2c[nH]cn2)CC(C1)c1ccc(cc1)C(C)(C)C

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Saltdata: HCl
Molecular Weight: 337.46
Empirical Formula: C21H27N3O

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 3.371
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 57
Number of rings: 3

     

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