General Information of the Compound
| Compound ID |
CP0268510
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| Compound Name |
N-[2-(4-methoxy-1-phenylindol-2-yl)ethyl]cyclopropanecarboxamide
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| Structure |
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| Formula |
C21H22N2O2
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| Molecular Weight |
334.419
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| Canonical SMILES |
COc1cccc2n(c(CCNC(=O)C3CC3)cc12)-c1ccccc1
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| InChI |
InChI=1S/C21H22N2O2/c1-25-20-9-5-8-19-18(20)14-17(12-13-22-21(24)15-10-11-15)23(19)16-6-3-2-4-7-16/h2-9,14-15H,10-13H2,1H3,(H,22,24)
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| InChIKey |
YNPLPFCIKOEQCH-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: PT01843, Melatonin receptor type 1A
Protein ID: PT02174, Melatonin receptor type 1B