General Information of the Compound
| Compound ID |
CP0522068
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| Compound Name |
Biphenyl-2-ylmethyl-(S)-pyrrolidin-3-yl-amine
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| Synonyms |
BDBM50262725
Biphenyl-2-ylmethyl-(S)-pyrrolidin-3-yl-amine
CHEMBL478836
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| Structure |
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| Formula |
C17H20N2
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| Molecular Weight |
252.361
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| Canonical SMILES |
C(N[C@H]1CCNC1)c1ccccc1-c1ccccc1
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| InChI |
InChI=1S/C17H20N2/c1-2-6-14(7-3-1)17-9-5-4-8-15(17)12-19-16-10-11-18-13-16/h1-9,16,18-19H,10-13H2/t16-/m0/s1
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| InChIKey |
DGKNIGATLZIOSX-INIZCTEOSA-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
Clinical Information about the Compound