COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK040630
Chemical Name: 4-{3-(4-fluorophenyl)-1-hydroxy-11-[4-(methoxycarbonyl)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}-4-oxobutanoicacid
Smiles: COC(=O)c1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)CCC(=O)O)cccc2)c1ccc(cc1)F

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Molecular Weight: 542.56
Empirical Formula: C31H27FN2O6

Physical State: Dry powder
Available Amount: 329 mg

Lipinsky:
logP: 5.174
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 116
Number of rings: 5

     

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