General Information of the Compound
| Compound ID |
CP0296630
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| Compound Name |
N-(1-adamantyl)-2-[4-[2-(tert-butylcarbamoylamino)ethyl]piperazin-1-yl]acetamide
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| Structure |
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| Formula |
C23H41N5O2
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| Molecular Weight |
419.614
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| Canonical SMILES |
CC(C)(C)NC(=O)NCCN1CCN(CC(=O)NC23CC4CC(CC(C4)C2)C3)CC1
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| InChI |
InChI=1S/C23H41N5O2/c1-22(2,3)26-21(30)24-4-5-27-6-8-28(9-7-27)16-20(29)25-23-13-17-10-18(14-23)12-19(11-17)15-23/h17-19H,4-16H2,1-3H3,(H,25,29)(H2,24,26,30)
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| InChIKey |
VZEDXJXJWSWRFK-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: PT00897, Potassium voltage-gated channel subfamily H member 2
Protein ID: PT04557, Voltage-dependent T-type calcium channel subunit alpha-1H