General Information of the Compound
| Compound ID |
CP0387636
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| Compound Name |
(3aS,6aR)-3a-naphthalen-2-yl-2,3,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
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| Structure |
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| Formula |
C17H19N
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| Molecular Weight |
237.346
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| Canonical SMILES |
C1C[C@H]2CNC[C@]2(C1)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C17H19N/c1-2-5-14-10-15(8-7-13(14)4-1)17-9-3-6-16(17)11-18-12-17/h1-2,4-5,7-8,10,16,18H,3,6,9,11-12H2/t16-,17+/m0/s1
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| InChIKey |
KZCROLYCBADBTI-DLBZAZTESA-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