COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK089100
Chemical Name: 11-(3,4-dimethoxyphenyl)-10-hexanoyl-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccc(c(c1)OC)OC)C(=O)CC(C2)c1ccc(cc1)OC

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Molecular Weight: 554.69
Empirical Formula: C34H38N2O5

Physical State: Dry powder
Available Amount: 551 mg

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

     

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