COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564658
Chemical Name: 1-[1-hydroxy-11-(4-methylphenyl)-3-(3-nitrophenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]propan-1-one
Smiles: CCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2cccc(c2)[N+](=O)[O-])C1c1ccc(cc1)C

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Molecular Weight: 481.55
Empirical Formula: C29H27N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.06
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 98
Number of rings: 5

     

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