General Information of the Compound
| Compound ID |
CP0540333
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| Compound Name |
2-[1-(5-methyl-1H-indole-2-carbonyl)piperidin-4-yl]acetic acid
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| Structure |
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| Formula |
C17H20N2O3
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| Molecular Weight |
300.358
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| Canonical SMILES |
Cc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC(O)=O)CC1
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| InChI |
InChI=1S/C17H20N2O3/c1-11-2-3-14-13(8-11)10-15(18-14)17(22)19-6-4-12(5-7-19)9-16(20)21/h2-3,8,10,12,18H,4-7,9H2,1H3,(H,20,21)
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| InChIKey |
QSTRMHABOYMJLT-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