General Information of the Compound
| Compound ID |
CP0429868
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| Compound Name |
(3aR,6aS)-2-methyl-3a-naphthalen-2-yl-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole
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| Structure |
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| Formula |
C18H21N
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| Molecular Weight |
251.373
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| Canonical SMILES |
CN1C[C@H]2CCC[C@]2(C1)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C18H21N/c1-19-12-17-7-4-10-18(17,13-19)16-9-8-14-5-2-3-6-15(14)11-16/h2-3,5-6,8-9,11,17H,4,7,10,12-13H2,1H3/t17-,18+/m1/s1
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| InChIKey |
QSOVYEIFTQKDEW-MSOLQXFVSA-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: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter