General Information of the Compound
| Compound ID |
CP0415489
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| Compound Name |
N-[3-[5-(2,4-dioxo-1,3,8-triazaspiro[4.5]decan-8-yl)pentanoyl]-4-methoxyphenyl]benzenesulfonamide
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| Structure |
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| Formula |
C25H30N4O6S
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| Molecular Weight |
514.604
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| Canonical SMILES |
COc1ccc(NS(=O)(=O)c2ccccc2)cc1C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O
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| InChI |
InChI=1S/C25H30N4O6S/c1-35-22-11-10-18(28-36(33,34)19-7-3-2-4-8-19)17-20(22)21(30)9-5-6-14-29-15-12-25(13-16-29)23(31)26-24(32)27-25/h2-4,7-8,10-11,17,28H,5-6,9,12-16H2,1H3,(H2,26,27,31,32)
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| InChIKey |
ZMFWTVIEIZWGCE-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: PT01448, 5-hydroxytryptamine receptor 1A
Protein ID: PT01480, 5-hydroxytryptamine receptor 2C