General Information of the Compound
| Compound ID |
CP0442413
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| Compound Name |
7-fluoro-N-[1-[[2-methoxy-4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]methyl]piperidin-4-yl]-4-oxochromene-2-carboxamide
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| Structure |
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| Formula |
C30H35FN4O5
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| Molecular Weight |
550.631
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| Canonical SMILES |
COc1cc(ccc1CN1CCC(CC1)NC(=O)c1cc(=O)c2ccc(F)cc2o1)C(=O)NCCN1CCCC1
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| InChI |
InChI=1S/C30H35FN4O5/c1-39-26-16-20(29(37)32-10-15-34-11-2-3-12-34)4-5-21(26)19-35-13-8-23(9-14-35)33-30(38)28-18-25(36)24-7-6-22(31)17-27(24)40-28/h4-7,16-18,23H,2-3,8-15,19H2,1H3,(H,32,37)(H,33,38)
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| InChIKey |
DMGSWCYGFARROW-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
Protein ID: PT01027, Melanin-concentrating hormone receptor 1
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2