General Information of the Compound
| Compound ID |
CP0666214
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| Compound Name |
(R)-N-((R)-1-(4-(6-(Pyridin-4-yl)quinazolin-2-ylamino)-phenyl)ethyl)pyrrolidine-2-carboxamide
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| Structure |
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| Formula |
C26H26N6O
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| Molecular Weight |
438.535
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| Canonical SMILES |
C[C@@H](NC(=O)[C@H]1CCCN1)c1ccc(Nc2ncc3cc(-c4ccncc4)ccc3n2)cc1
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| InChI |
InChI=1S/C26H26N6O/c1-17(30-25(33)24-3-2-12-28-24)18-4-7-22(8-5-18)31-26-29-16-21-15-20(6-9-23(21)32-26)19-10-13-27-14-11-19/h4-11,13-17,24,28H,2-3,12H2,1H3,(H,30,33)(H,29,31,32)/t17-,24-/m1/s1
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| InChIKey |
VNTPCWOWTJRXIO-MZNJEOGPSA-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