General Information of the Compound
| Compound ID |
CP0381424
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| Compound Name |
1-[1-(Naphthalene-1-sulfonyl)-piperidin-4-yl]-1,4-dihydro-benzo[d][1,3]oxazin-2-one
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| Structure |
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| Formula |
C23H22N2O4S
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| Molecular Weight |
422.506
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| Canonical SMILES |
O=C1OCc2ccccc2N1C1CCN(CC1)S(=O)(=O)c1cccc2ccccc12
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| InChI |
InChI=1S/C23H22N2O4S/c26-23-25(21-10-4-2-7-18(21)16-29-23)19-12-14-24(15-13-19)30(27,28)22-11-5-8-17-6-1-3-9-20(17)22/h1-11,19H,12-16H2
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| InChIKey |
TYYXFZFUUWYFQO-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