COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK725410
Chemical Name: N-[(1Z)-3-(azepan-1-yl)-1-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide
Smiles: COc1ccc(cc1OC)/C=C(/C(=O)N1CCCCCC1)\NC(=O)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 464.6
Empirical Formula: C28H36N2O4

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 5.082
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 3

     

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