COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562629
Chemical Name: (4-bromophenyl)[1-hydroxy-3,3-dimethyl-11-(3-nitrophenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]methanone
Smiles: Brc1ccc(cc1)C(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)(C)C)C1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 546.42
Empirical Formula: C28H24BrN3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.248
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 98
Number of rings: 5

     

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