COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK392585
Chemical Name: 11-(furan-2-yl)-10-hexanoyl-3-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccco1)C(=O)CC(C2)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 499.57
Empirical Formula: C29H29N3O5

Physical State: Dry powder
Available Amount: 159 mg

Lipinsky:
logP: 5.492
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 108
Number of rings: 5

     

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