General Information of the Compound
| Compound ID |
CP0502231
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| Compound Name |
N-[(2-phenylphenyl)methyl]-N-[(3S)-pyrrolidin-3-yl]formamide
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| Structure |
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| Formula |
C18H20N2O
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| Molecular Weight |
280.371
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| Canonical SMILES |
O=CN(Cc1ccccc1-c1ccccc1)[C@H]1CCNC1
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| InChI |
InChI=1S/C18H20N2O/c21-14-20(17-10-11-19-12-17)13-16-8-4-5-9-18(16)15-6-2-1-3-7-15/h1-9,14,17,19H,10-13H2/t17-/m0/s1
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| InChIKey |
HYXUARRYTJMRKQ-KRWDZBQOSA-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