General Information of the Compound
| Compound ID |
CP0488313
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| Compound Name |
N-[(1-cyclohexyltetrazol-5-yl)methyl]-4,4-diphenylbutan-1-amine
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| Structure |
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| Formula |
C24H31N5
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| Molecular Weight |
389.547
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| Canonical SMILES |
C(CNCc1nnnn1C1CCCCC1)CC(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C24H31N5/c1-4-11-20(12-5-1)23(21-13-6-2-7-14-21)17-10-18-25-19-24-26-27-28-29(24)22-15-8-3-9-16-22/h1-2,4-7,11-14,22-23,25H,3,8-10,15-19H2
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| InChIKey |
JENBRVXGKFPMSM-UHFFFAOYSA-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: PT03705, Sodium- and chloride-dependent GABA transporter 2
Protein ID: PT03076, Sodium- and chloride-dependent GABA transporter 3