COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK029165
Chemical Name: 1-[3-(4-tert-butylphenyl)-11-(3,4-dimethoxyphenyl)-1-hydroxy-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone
Smiles: COc1cc(ccc1OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C)cccc2)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 524.66
Empirical Formula: C33H36N2O4

Physical State: Dry powder
Available Amount: 364 mg

Lipinsky:
logP: 6.764
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 5

     

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