General Information of the Compound
| Compound ID |
CP0437206
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| Compound Name |
(Z)-N-(5-aminopentyl)-4-(1H-indol-3-yl)-N-(2-methyl-3-phenylallyl)butanamide
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| Structure |
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| Formula |
C27H35N3O
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| Molecular Weight |
417.597
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| Canonical SMILES |
C\C(CN(CCCCCN)C(=O)CCCc1c[nH]c2ccccc12)=C\c1ccccc1
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| InChI |
InChI=1S/C27H35N3O/c1-22(19-23-11-4-2-5-12-23)21-30(18-9-3-8-17-28)27(31)16-10-13-24-20-29-26-15-7-6-14-25(24)26/h2,4-7,11-12,14-15,19-20,29H,3,8-10,13,16-18,21,28H2,1H3/b22-19-
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| InChIKey |
FKQWUEMIQYIXGE-QOCHGBHMSA-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