General Information of the Compound
| Compound ID |
CP0506462
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| Compound Name |
1-{5-[4-(1H)-benzimidazol-4-yl)piperazin-1-yl]pentyl}-1,3-dihydro-2H-indol-2-one
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| Structure |
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| Formula |
C24H29N5O
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| Molecular Weight |
403.53
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| Canonical SMILES |
O=C1Cc2ccccc2N1CCCCCN1CCN(CC1)c1cccc2[nH]cnc12
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| InChI |
InChI=1S/C24H29N5O/c30-23-17-19-7-2-3-9-21(19)29(23)12-5-1-4-11-27-13-15-28(16-14-27)22-10-6-8-20-24(22)26-18-25-20/h2-3,6-10,18H,1,4-5,11-17H2,(H,25,26)
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| InChIKey |
XNSRYAXPXINABJ-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: PT00941, 5-hydroxytryptamine receptor 7