General Information of the Compound
| Compound ID |
CP0541086
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| Compound Name |
N-[4-(1-cyclobutylpiperidin-4-yl)oxy-2-methylphenyl]-2-pyrrolidin-1-ylacetamide;dihydrochloride
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| Structure |
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| Formula |
C22H35Cl2N3O2
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| Molecular Weight |
444.447
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| Canonical SMILES |
Cl.Cl.Cc1cc(OC2CCN(CC2)C2CCC2)ccc1NC(=O)CN1CCCC1
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| InChI |
InChI=1S/C22H33N3O2.2ClH/c1-17-15-20(27-19-9-13-25(14-10-19)18-5-4-6-18)7-8-21(17)23-22(26)16-24-11-2-3-12-24;;/h7-8,15,18-19H,2-6,9-14,16H2,1H3,(H,23,26);2*1H
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| InChIKey |
SBWGIFHQYDTPNP-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