COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK407746
Chemical Name: 3-(2,5-dimethoxyphenyl)-7,8-dimethyl-11-(pyridin-4-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(c(c1)C1CC(=O)C2=C(C1)Nc1cc(C)c(cc1NC2c1ccncc1)C)OC

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Molecular Weight: 455.56
Empirical Formula: C28H29N3O3

Physical State: Dry powder
Available Amount: 199 mg

Lipinsky:
logP: 3.352
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 72
Number of rings: 5

     

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