General Information of the Compound
| Compound ID |
CP0426880
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| Compound Name |
N-(cyclopropylmethyl)-N-[3-(4-phenylpiperazin-1-yl)propyl]naphthalene-2-sulfonamide
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| Structure |
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| Formula |
C27H33N3O2S
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| Molecular Weight |
463.647
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| Canonical SMILES |
O=S(=O)(N(CCCN1CCN(CC1)c1ccccc1)CC1CC1)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C27H33N3O2S/c31-33(32,27-14-13-24-7-4-5-8-25(24)21-27)30(22-23-11-12-23)16-6-15-28-17-19-29(20-18-28)26-9-2-1-3-10-26/h1-5,7-10,13-14,21,23H,6,11-12,15-20,22H2
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| InChIKey |
MLMHNPCGKOQQQO-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C
Protein ID: PT00941, 5-hydroxytryptamine receptor 7