COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL001041
Chemical Name: 1-(4-fluorophenyl)-4-(1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)butan-1-one
Smiles: Fc1ccc(cc1)C(=O)CCCN1CCc2c(CC1)cccc2

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Saltdata: HCI
Molecular Weight: 311.4
Empirical Formula: C20H22FNO

Physical State: Dry powder
Available Amount: 726 mg

Lipinsky:
logP: 4.276
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 20
Number of rings: 3

     

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