General Information of the Compound
| Compound ID |
CP0128477
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| Compound Name |
4-(2-Amino-5-(benzo[d][1,3]dioxol-4-yl)pyridin-3-yl)benzamide
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| Structure |
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| Formula |
C19H15N3O3
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| Molecular Weight |
333.347
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| Canonical SMILES |
NC(=O)c1ccc(cc1)-c1cc(cnc1N)-c1cccc2OCOc12
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| InChI |
InChI=1S/C19H15N3O3/c20-18-15(11-4-6-12(7-5-11)19(21)23)8-13(9-22-18)14-2-1-3-16-17(14)25-10-24-16/h1-9H,10H2,(H2,20,22)(H2,21,23)
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| InChIKey |
UBOGEBHIZSQBBD-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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