General Information of the Compound
| Compound ID |
CP0528554
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| Compound Name |
N-(cyclopropylmethyl)-N-[3-(4-pyridin-2-ylpiperazin-1-yl)propyl]benzamide
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| Formula |
C23H30N4O
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| Molecular Weight |
378.52
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| Canonical SMILES |
O=C(N(CCCN1CCN(CC1)c1ccccn1)CC1CC1)c1ccccc1
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| InChI |
InChI=1S/C23H30N4O/c28-23(21-7-2-1-3-8-21)27(19-20-10-11-20)14-6-13-25-15-17-26(18-16-25)22-9-4-5-12-24-22/h1-5,7-9,12,20H,6,10-11,13-19H2
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| InChIKey |
SHULDTNTBVWTML-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00825, 5-hydroxytryptamine receptor 2A