COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL172254
Chemical Name: 3-(3,4-dimethoxyphenyl)-10-hexanoyl-11-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCCC(=O)N1C(c2ccc(cc2)OC)C2=C(Nc3c1cccc3)CC(CC2=O)c1ccc(c(c1)OC)OC

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Molecular Weight: 554.69
Empirical Formula: C34H38N2O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.253
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 77
Number of rings: 5

     

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