General Information of the Compound
| Compound ID |
CP0558605
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| Compound Name |
[2-chloro-4-(methylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol
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| Structure |
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| Formula |
C26H22ClN5O
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| Molecular Weight |
455.949
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| Canonical SMILES |
CNc1c(c(Cl)nc2ccc(cc12)C(O)(c1cncn1C)c1ccncc1)-c1ccccc1
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| InChI |
InChI=1S/C26H22ClN5O/c1-28-24-20-14-19(8-9-21(20)31-25(27)23(24)17-6-4-3-5-7-17)26(33,18-10-12-29-13-11-18)22-15-30-16-32(22)2/h3-16,33H,1-2H3,(H,28,31)
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| InChIKey |
NMJXWKWIUBPQBN-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