COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK040009
Chemical Name: 4-[1-hydroxy-3,11-bis(4-methylphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(cc2)C)C1c1ccc(cc1)C

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Molecular Weight: 494.59
Empirical Formula: C31H30N2O4

Physical State: Dry powder
Available Amount: 403 mg

Lipinsky:
logP: 6.065
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 90
Number of rings: 5

     

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