General Information of the Compound
| Compound ID |
CP0395801
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| Compound Name |
(11aR)-10-propoxy-1,2,3,4,11,11a-hexahydropyrazino[1,2-b]isoquinolin-6-one
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| Structure |
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| Formula |
C15H20N2O2
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| Molecular Weight |
260.337
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| Canonical SMILES |
CCCOc1cccc2C(=O)N3CCNC[C@H]3Cc12
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| InChI |
InChI=1S/C15H20N2O2/c1-2-8-19-14-5-3-4-12-13(14)9-11-10-16-6-7-17(11)15(12)18/h3-5,11,16H,2,6-10H2,1H3/t11-/m1/s1
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| InChIKey |
DXXYZQKYSNINFR-LLVKDONJSA-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C