General Information of the Compound
| Compound ID |
CP0131014
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| Compound Name |
4-[5-(2-chloroanilino)-6-fluoroindazol-1-yl]-N-methylthiophene-2-carboxamide
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| Structure |
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| Formula |
C19H14ClFN4OS
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| Molecular Weight |
400.866
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| Canonical SMILES |
CNC(=O)c1cc(cs1)-n1ncc2cc(Nc3ccccc3Cl)c(F)cc12
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| InChI |
InChI=1S/C19H14ClFN4OS/c1-22-19(26)18-7-12(10-27-18)25-17-8-14(21)16(6-11(17)9-23-25)24-15-5-3-2-4-13(15)20/h2-10,24H,1H3,(H,22,26)
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| InChIKey |
XMMMCYBZGARUKP-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