COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK095535
Chemical Name: 4-{3-[4-(dimethylamino)phenyl]-1-oxo-11-phenyl-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1c2ccccc2NC2=C(C1c1ccccc1)C(=O)CC(C2)c1ccc(cc1)N(C)C

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Molecular Weight: 509.6
Empirical Formula: C31H31N3O4

Physical State: Dry powder
Available Amount: 332 mg

Lipinsky:
logP: 4.391
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 89
Number of rings: 5

     

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