COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149686
Chemical Name: 1-{3-(4-fluorophenyl)-1-hydroxy-11-[4-(pentyloxy)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}hexan-1-one
Smiles: CCCCCC(=O)N1C(c2ccc(cc2)OCCCCC)C2=C(O)CC(CC2=Nc2c1cccc2)c1ccc(cc1)F

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Molecular Weight: 568.73
Empirical Formula: C36H41FN2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.556
Rotatable bonds: 9
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 5

     

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