COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL160828
Chemical Name: 2-{2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl}-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Smiles: Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)Cn1nc2CCCCCc2cc1=O

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Molecular Weight: 415.92
Empirical Formula: C22H26ClN3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.099
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 73
Number of rings: 4

     

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