General Information of the Compound
| Compound ID |
CP0901481
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| Compound Name |
3-((4-(Aminomethyl)pyridin-2-yl)oxy)-N-(4-fluorophenyl)-benzamide Hydrochloride
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| Structure |
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| Formula |
C19H17ClFN3O2
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| Molecular Weight |
373.815
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| Canonical SMILES |
Cl.NCc1ccnc(Oc2cccc(C(=O)Nc3ccc(F)cc3)c2)c1
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| InChI |
InChI=1S/C19H16FN3O2.ClH/c20-15-4-6-16(7-5-15)23-19(24)14-2-1-3-17(11-14)25-18-10-13(12-21)8-9-22-18;/h1-11H,12,21H2,(H,23,24);1H
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| InChIKey |
TXTWMOYDDSJLQU-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: PT04868, Lysyl oxidase homolog 2
Protein ID: PT05764, Protein-lysine 6-oxidase