COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK088220
Chemical Name: [3-(4-tert-butylphenyl)-1-hydroxy-11-(3,4,5-trimethoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl](phenyl)methanone
Smiles: COc1c(OC)cc(cc1OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)c1ccccc1)cccc2)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 616.76
Empirical Formula: C39H40N2O5

Physical State: Dry powder
Available Amount: 599 mg

Lipinsky:
logP: 8.336
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 80
Number of rings: 6

     

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