LY344864

Ligand id: 21

Name: LY344864

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 48.13
Molecular weight 351.17
XLogP 3.7
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Selectivity at GPCRs
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
5-HT1F receptor Hs Agonist Full agonist 8.2 pKi - 1
pKi 8.2 (Ki 6.31x10-9 M) [1]
5-HT1A receptor Hs Agonist Full agonist 6.3 pKi - 1
pKi 6.3 [1]
5-HT1B receptor Hs Agonist Full agonist 6.3 pKi - 1
pKi 6.3 [1]
5-HT1D receptor Hs Agonist Full agonist 6.2 pKi - 1
pKi 6.2 [1]
5-ht1e receptor Hs Agonist Full agonist 5.8 pKi - 1
pKi 5.8 [1]
5-HT2B receptor Hs Agonist Full agonist 5.8 pKi - 1
pKi 5.8 [1]
5-HT2C receptor Hs Agonist Full agonist 5.5 pKi - 1
pKi 5.5 [1]
5-HT2A receptor Hs Agonist Full agonist 5.4 pKi - 1
pKi 5.4 [1]
5-HT7 receptor Hs Agonist Full agonist 5.3 pKi - 1
pKi 5.3 [1]