General Information of the Compound
| Compound ID |
CP0503084
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| Compound Name |
6-(4-hydroxy-3-methoxyphenyl)-3-(5-(piperidin-1-ylmethyl)-1H-indol-2-yl)quinolin-2(1H)-one
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| Structure |
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| Formula |
C30H29N3O3
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| Molecular Weight |
479.58
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| Canonical SMILES |
COc1cc(ccc1O)-c1ccc2[nH]c(=O)c(cc2c1)-c1cc2cc(CN3CCCCC3)ccc2[nH]1
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| InChI |
InChI=1S/C30H29N3O3/c1-36-29-17-21(7-10-28(29)34)20-6-9-26-23(14-20)15-24(30(35)32-26)27-16-22-13-19(5-8-25(22)31-27)18-33-11-3-2-4-12-33/h5-10,13-17,31,34H,2-4,11-12,18H2,1H3,(H,32,35)
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| InChIKey |
QSCYNBDSVWIZMP-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