General Information of the Compound
| Compound ID |
CP0382205
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| Compound Name |
2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridine-7,8-diol
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| Structure |
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| Formula |
C12H15NO2
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| Molecular Weight |
205.257
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| Canonical SMILES |
Oc1cc2CC3CCCNC3c2cc1O
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| InChI |
InChI=1S/C12H15NO2/c14-10-5-8-4-7-2-1-3-13-12(7)9(8)6-11(10)15/h5-7,12-15H,1-4H2
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| InChIKey |
QIWLGVDDXIYFFV-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01843, Melatonin receptor type 1A
Protein ID: PT02174, Melatonin receptor type 1B