COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK022593
Chemical Name: 1-{11-[2-(butan-2-yloxy)phenyl]-3-(3,4-dimethoxyphenyl)-1-hydroxy-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}ethanone
Smiles: CCC(Oc1ccccc1C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C)cccc2)c1ccc(c(c1)OC)OC)C

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Molecular Weight: 540.66
Empirical Formula: C33H36N2O5

Physical State: Dry powder
Available Amount: 409 mg

Lipinsky:
logP: 6.401
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 80
Number of rings: 5

     

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