COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK316003
Chemical Name: 3- (4- methylphenyl)- 11- (3- nitrophenyl)- 10- propanoyl- 2,3,4,5,10,11- hexahydro- 1H- dibenzo[b,e][1,4]diazepin- 1- one
Smiles: CCC(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CC(C2)c1ccc(cc1)C

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Molecular Weight: 481.55
Empirical Formula: C29H27N3O4

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.197
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 5

     

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