COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044372
Chemical Name: 1-[11-(furan-2-yl)-1-hydroxy-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-])C1c1ccco1

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Molecular Weight: 457.49
Empirical Formula: C26H23N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.761
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 111
Number of rings: 5

     

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