General Information of the Compound
| Compound ID |
CP0578986
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| Compound Name |
N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-2-pyrrolidin-1-ylacetamide;dihydrochloride
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| Structure |
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| Formula |
C21H33Cl2N3O2
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| Molecular Weight |
430.42
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| Canonical SMILES |
Cl.Cl.O=C(CN1CCCC1)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
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| InChI |
InChI=1S/C21H31N3O2.2ClH/c25-21(16-23-12-1-2-13-23)22-17-6-8-19(9-7-17)26-20-10-14-24(15-11-20)18-4-3-5-18;;/h6-9,18,20H,1-5,10-16H2,(H,22,25);2*1H
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| InChIKey |
ORTPSQJDHIOWTC-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