General Information of the Compound
| Compound ID |
CP0428482
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| Compound Name |
(Z)-N-(5-aminopentyl)-4-(1H-indol-3-yl)-N-(3-phenylallyl)butanamide
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| Structure |
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| Formula |
C26H33N3O
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| Molecular Weight |
403.57
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| Canonical SMILES |
NCCCCCN(C\C=C/c1ccccc1)C(=O)CCCc1c[nH]c2ccccc12
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| InChI |
InChI=1S/C26H33N3O/c27-18-7-2-8-19-29(20-10-13-22-11-3-1-4-12-22)26(30)17-9-14-23-21-28-25-16-6-5-15-24(23)25/h1,3-6,10-13,15-16,21,28H,2,7-9,14,17-20,27H2/b13-10-
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| InChIKey |
VBCZGNUFSTWKJO-RAXLEYEMSA-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: PT01325, Melanocortin receptor 3
Protein ID: PT00914, Melanocortin receptor 4
Protein ID: PT01804, Melanocortin receptor 5
Protein ID: PT01440, Melanocyte-stimulating hormone receptor