General Information of the Compound
| Compound ID |
CP0371784
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| Compound Name |
(R)-2-(4-(1-(thiazol-4-ylmethyl)-1H-indazol-5-ylamino)quinazolin-5-yloxy)propanamide
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| Structure |
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| Formula |
C22H19N7O2S
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| Molecular Weight |
445.508
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| Canonical SMILES |
C[C@@H](Oc1cccc2ncnc(Nc3ccc4n(Cc5cscn5)ncc4c3)c12)C(N)=O
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| InChI |
InChI=1S/C22H19N7O2S/c1-13(21(23)30)31-19-4-2-3-17-20(19)22(25-11-24-17)28-15-5-6-18-14(7-15)8-27-29(18)9-16-10-32-12-26-16/h2-8,10-13H,9H2,1H3,(H2,23,30)(H,24,25,28)/t13-/m1/s1
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| InChIKey |
RVVGPIUUCSXRDL-CYBMUJFWSA-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