COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK624184
Chemical Name: {(11Z)-11-[3-(dimethylamino)propylidene]-6,11-dihydrodibenzo[b,e]oxepin-2-yl}aceticacid
Smiles: CN(CC/C=C/1\c2cc(ccc2OCc2c1cccc2)CC(=O)O)C

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Saltdata: HCl
Molecular Weight: 337.42
Empirical Formula: C21H23NO3

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 3.143
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 49
Number of rings: 3

     

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