COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK136213
Chemical Name: 11-(2,3-dimethoxyphenyl)-10-hexanoyl-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCCC(=O)N1c2ccccc2NC2=C(C1c1cccc(c1OC)OC)C(=O)CC(C2)(C)C

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Molecular Weight: 476.62
Empirical Formula: C29H36N2O4

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 5.706
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 4

     

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