General Information of the Compound
| Compound ID |
CP0398312
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| Compound Name |
2-[[4-anilino-1-(2-phenylethyl)piperidin-4-yl]methyl]guanidine
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| Structure |
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| Formula |
C21H29N5
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| Molecular Weight |
351.498
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| Canonical SMILES |
NC(=N)NCC1(CCN(CCc2ccccc2)CC1)Nc1ccccc1
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| InChI |
InChI=1S/C21H29N5/c22-20(23)24-17-21(25-19-9-5-2-6-10-19)12-15-26(16-13-21)14-11-18-7-3-1-4-8-18/h1-10,25H,11-17H2,(H4,22,23,24)
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| InChIKey |
VADIXMBKNYJACB-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: PT04406, Neuropeptide FF receptor 1
Protein ID: PT02666, Neuropeptide FF receptor 2