General Information of the Compound
| Compound ID |
CP0493563
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| Compound Name |
N-(2-aminoethyl)-N-(naphthalen-2-ylmethyl)-1H-indole-3-carboxamide
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| Structure |
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| Formula |
C22H21N3O
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| Molecular Weight |
343.43
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| Canonical SMILES |
NCCN(Cc1ccc2ccccc2c1)C(=O)c1c[nH]c2ccccc12
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| InChI |
InChI=1S/C22H21N3O/c23-11-12-25(15-16-9-10-17-5-1-2-6-18(17)13-16)22(26)20-14-24-21-8-4-3-7-19(20)21/h1-10,13-14,24H,11-12,15,23H2
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| InChIKey |
NOTXYWDYLWWZMC-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: PT00914, Melanocortin receptor 4
Protein ID: PT01804, Melanocortin receptor 5
Protein ID: PT01440, Melanocyte-stimulating hormone receptor