COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK037544
Chemical Name: 4-{3-[4-(diethylamino)phenyl]-1-oxo-11-phenyl-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}-4-oxobutanoicacid
Smiles: CCN(c1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccccc1)C(=O)CCC(=O)O)CC

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Molecular Weight: 537.66
Empirical Formula: C33H35N3O4

Physical State: Dry powder
Available Amount: 510 mg

Lipinsky:
logP: 5.453
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 89
Number of rings: 5

     

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