General Information of the Compound
| Compound ID |
CP0383358
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| Compound Name |
N-[2-(7-methoxy-2-propoxynaphthalen-1-yl)ethyl]propanamide
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| Structure |
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| Formula |
C19H25NO3
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| Molecular Weight |
315.413
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| Canonical SMILES |
CCCOc1ccc2ccc(OC)cc2c1CCNC(=O)CC
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| InChI |
InChI=1S/C19H25NO3/c1-4-12-23-18-9-7-14-6-8-15(22-3)13-17(14)16(18)10-11-20-19(21)5-2/h6-9,13H,4-5,10-12H2,1-3H3,(H,20,21)
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| InChIKey |
KKTBZZNHOOYXHB-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