COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL444603
Chemical Name: 3-(3,4-dimethoxyphenyl)-10-hexanoyl-11-(3,4,5-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCCC(=O)N1C(c2cc(OC)c(c(c2)OC)OC)C2=C(Nc3c1cccc3)CC(CC2=O)c1ccc(c(c1)OC)OC

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Molecular Weight: 614.74
Empirical Formula: C36H42N2O7

Physical State: Dry powder
Available Amount: 380 mg

Lipinsky:
logP: 5.777
Rotatable bonds: 9
H-donors: 1
H-acceptors: 7
PSA: 95
Number of rings: 5

     

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