COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL558351
Chemical Name: 3,3-dimethyl-10-pentanoyl-11-(3,4,5-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCCC(=O)N1C(c2cc(OC)c(c(c2)OC)OC)C2=C(Nc3c1cccc3)CC(CC2=O)(C)C

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Molecular Weight: 492.62
Empirical Formula: C29H36N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.877
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 77
Number of rings: 4

     

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