General Information of the Compound
| Compound ID |
CP0548326
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| Compound Name |
5-[6-(methylaminomethyl)pyrimidin-4-yl]oxy-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]indole-1-carboxamide
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| Structure |
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| Formula |
C19H16F3N7O2
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| Molecular Weight |
431.378
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| Canonical SMILES |
CNCc1cc(Oc2ccc3n(ccc3c2)C(=O)Nc2cc([nH]n2)C(F)(F)F)ncn1
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| InChI |
InChI=1S/C19H16F3N7O2/c1-23-9-12-7-17(25-10-24-12)31-13-2-3-14-11(6-13)4-5-29(14)18(30)26-16-8-15(27-28-16)19(20,21)22/h2-8,10,23H,9H2,1H3,(H2,26,27,28,30)
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| InChIKey |
YYVLMFCXOIWUHX-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