COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK149711
Chemical Name: 4-[11-(4-tert-butylphenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1C(c2ccc(cc2)C(C)(C)C)C2=C(Nc3c1cccc3)CC(CC2=O)(C)C

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Molecular Weight: 474.6
Empirical Formula: C29H34N2O4

Physical State: Dry powder
Available Amount: 159 mg

Lipinsky:
logP: 5.338
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 86
Number of rings: 4

     

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