General Information of the Compound
| Compound ID |
CP0482285
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| Compound Name |
N-[2-[[[3-[6-(piperidin-4-ylamino)pyridin-3-yl]-1H-indazol-5-yl]amino]methyl]phenyl]methanesulfonamide
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| Structure |
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| Formula |
C25H29N7O2S
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| Molecular Weight |
491.621
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| Canonical SMILES |
CS(=O)(=O)Nc1ccccc1CNc1ccc2[nH]nc(-c3ccc(NC4CCNCC4)nc3)c2c1
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| InChI |
InChI=1S/C25H29N7O2S/c1-35(33,34)32-22-5-3-2-4-17(22)15-27-20-7-8-23-21(14-20)25(31-30-23)18-6-9-24(28-16-18)29-19-10-12-26-13-11-19/h2-9,14,16,19,26-27,32H,10-13,15H2,1H3,(H,28,29)(H,30,31)
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| InChIKey |
FIBVTKLVMWYXQC-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