General Information of the Compound
| Compound ID |
CP0317015
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| Compound Name |
5-(2-isobutylpiperazin-1-yl)-1H-indazole
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| Structure |
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| Formula |
C15H22N4
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| Molecular Weight |
258.369
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| Canonical SMILES |
CC(C)CC1CNCCN1c1ccc2[nH]ncc2c1
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| InChI |
InChI=1S/C15H22N4/c1-11(2)7-14-10-16-5-6-19(14)13-3-4-15-12(8-13)9-17-18-15/h3-4,8-9,11,14,16H,5-7,10H2,1-2H3,(H,17,18)
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| InChIKey |
CJIGYBHHAXYYSY-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: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter