General Information of the Compound
| Compound ID |
CP0485894
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| Compound Name |
(R)-N-methyl-2-(4-(1-(pyridin-2-ylmethyl)-1H-indazol-5-ylamino)quinazolin-5-yloxy)propanamide
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| Structure |
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| Formula |
C25H23N7O2
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| Molecular Weight |
453.506
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| Canonical SMILES |
CNC(=O)[C@@H](C)Oc1cccc2ncnc(Nc3ccc4n(Cc5ccccn5)ncc4c3)c12
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| InChI |
InChI=1S/C25H23N7O2/c1-16(25(33)26-2)34-22-8-5-7-20-23(22)24(29-15-28-20)31-18-9-10-21-17(12-18)13-30-32(21)14-19-6-3-4-11-27-19/h3-13,15-16H,14H2,1-2H3,(H,26,33)(H,28,29,31)/t16-/m1/s1
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| InChIKey |
PMDGVRFVXOHVGF-MRXNPFEDSA-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