General Information of the Compound
| Compound ID |
CP0177513
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| Compound Name |
N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-5-methylpyrrolo[2,1-f][1,2,4]triazin-4-amine
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| Structure |
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| Formula |
C20H16ClFN4O
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| Molecular Weight |
382.826
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| Canonical SMILES |
Cc1ccn2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c12
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| InChI |
InChI=1S/C20H16ClFN4O/c1-13-7-8-26-19(13)20(23-12-24-26)25-16-5-6-18(17(21)10-16)27-11-14-3-2-4-15(22)9-14/h2-10,12H,11H2,1H3,(H,23,24,25)
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| InChIKey |
UXFJZTSGDOCCSL-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