General Information of the Compound
| Compound ID |
CP0918263
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| Compound Name |
4-(4-phenoxybenzamido)butylamine hydrochloride
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| Structure |
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| Formula |
C17H21ClN2O2
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| Molecular Weight |
320.82
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| Canonical SMILES |
Cl.NCCCCNC(=O)c1ccc(Oc2ccccc2)cc1
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| InChI |
InChI=1S/C17H20N2O2.ClH/c18-12-4-5-13-19-17(20)14-8-10-16(11-9-14)21-15-6-2-1-3-7-15;/h1-3,6-11H,4-5,12-13,18H2,(H,19,20);1H
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| InChIKey |
SNFNDCNGADACGC-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: PT03226, Trace amine-associated receptor 1
Protein ID: PT03501, Trace amine-associated receptor 1