COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK677931
Chemical Name: 11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-3-phenyl-10-(thiophen-2-ylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1C2=C(CC(CC2=O)c2ccccc2)Nc2c(N1C(=O)c1cccs1)cccc2

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Molecular Weight: 661.22
Empirical Formula: C39H33ClN2O4S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 8.468
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 96
Number of rings: 7

     

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