COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK723560
Chemical Name: N-{(1E)-3-(azepan-1-yl)-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}-2-chlorobenzamide
Smiles: O=C(/C(=C\c1ccc(cc1)N(C)C)/NC(=O)c1ccccc1Cl)N1CCCCCC1

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Molecular Weight: 425.96
Empirical Formula: C24H28ClN3O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.246
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 3

     

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