General Information of the Compound
| Compound ID |
CP0377067
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| Compound Name |
N-[1-[3-(3-oxo-1,4-benzoxazin-4-yl)propyl]piperidin-4-yl]cyclopentanecarboxamide
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| Structure |
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| Formula |
C22H31N3O3
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| Molecular Weight |
385.508
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| Canonical SMILES |
O=C(NC1CCN(CCCN2C(=O)COc3ccccc23)CC1)C1CCCC1
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| InChI |
InChI=1S/C22H31N3O3/c26-21-16-28-20-9-4-3-8-19(20)25(21)13-5-12-24-14-10-18(11-15-24)23-22(27)17-6-1-2-7-17/h3-4,8-9,17-18H,1-2,5-7,10-16H2,(H,23,27)
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| InChIKey |
GVBRUTKAGONHPQ-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