General Information of the Compound
| Compound ID |
CP0573228
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| Compound Name |
[4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]piperazin-1-yl]-(1-methylindazol-3-yl)methanone
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| Structure |
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| Formula |
C26H34N6O2
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| Molecular Weight |
462.598
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| Canonical SMILES |
COc1ccccc1N1CCN(CCN2CCN(CC2)C(=O)c2nn(C)c3ccccc23)CC1
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| InChI |
InChI=1S/C26H34N6O2/c1-28-22-8-4-3-7-21(22)25(27-28)26(33)32-19-15-30(16-20-32)12-11-29-13-17-31(18-14-29)23-9-5-6-10-24(23)34-2/h3-10H,11-20H2,1-2H3
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| InChIKey |
UDFSBKOWQSCWPJ-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01005, D(2) dopamine receptor