COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL482227
Chemical Name: 11-(3-iodophenyl)-3,3-dimethyl-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Ic1cccc(c1)C1C2=C(Nc3c(N1C(=O)Cc1ccccc1)cccc3)CC(CC2=O)(C)C

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Molecular Weight: 562.45
Empirical Formula: C29H27IN2O2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 6.681
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 49
Number of rings: 5

     

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