General Information of the Compound
| Compound ID |
CP0877869
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| Compound Name |
6-Chloro-4-[1-(1-methyl-1H-indol-6-ylmethyl)-piperidin-4-ylamino]-chromen-2-one
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| Formula |
C24H24ClN3O2
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| Molecular Weight |
421.928
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| Canonical SMILES |
Cn1ccc2ccc(CN3CCC(/N=c4\cc(O)oc5ccc(Cl)cc45)CC3)cc21
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| InChI |
InChI=1S/C24H24ClN3O2/c1-27-9-6-17-3-2-16(12-22(17)27)15-28-10-7-19(8-11-28)26-21-14-24(29)30-23-5-4-18(25)13-20(21)23/h2-6,9,12-14,19,29H,7-8,10-11,15H2,1H3/b26-21+
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| InChIKey |
LBIYINAQWOZHMS-YYADALCUSA-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