General Information of the Compound
| Compound ID |
CP0352393
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| Compound Name |
3-(5-((4-acetylpiperazin-1-yl)methyl)-1H-indol-2-yl)-6-(1H-pyrazol-4-yl)quinolin-2(1H)-one
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| Structure |
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| Formula |
C27H26N6O2
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| Molecular Weight |
466.545
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| Canonical SMILES |
CC(=O)N1CCN(Cc2ccc3[nH]c(cc3c2)-c2cc3cc(ccc3[nH]c2=O)-c2cn[nH]c2)CC1
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| InChI |
InChI=1S/C27H26N6O2/c1-17(34)33-8-6-32(7-9-33)16-18-2-4-24-20(10-18)13-26(30-24)23-12-21-11-19(22-14-28-29-15-22)3-5-25(21)31-27(23)35/h2-5,10-15,30H,6-9,16H2,1H3,(H,28,29)(H,31,35)
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| InChIKey |
YZAHMIZAOIVVEF-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