General Information of the Compound
| Compound ID |
CP0278569
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| Compound Name |
5-(2-phenethylpiperazin-1-yl)-1H-indazole
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| Synonyms |
5-(2-phenethylpiperazin-1-yl)-1H-indazole
CHEMBL1170373
SCHEMBL2944873
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| Structure |
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| Formula |
C19H22N4
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| Molecular Weight |
306.413
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| Canonical SMILES |
C(Cc1ccccc1)C1CNCCN1c1ccc2[nH]ncc2c1
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| InChI |
InChI=1S/C19H22N4/c1-2-4-15(5-3-1)6-7-18-14-20-10-11-23(18)17-8-9-19-16(12-17)13-21-22-19/h1-5,8-9,12-13,18,20H,6-7,10-11,14H2,(H,21,22)
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| InChIKey |
OOXRIQOVBUMMQG-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
Clinical Information about the Compound