General Information of the Compound
| Compound ID |
CP0383054
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| Compound Name |
N-(2-hydroxy-2-phenylethyl)-6-(4-methoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-1'-yl)pyridazine-3-carboxamide
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| Structure |
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| Formula |
C27H30N4O4
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| Molecular Weight |
474.561
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| Canonical SMILES |
COC1CC2(CCN(CC2)c2ccc(nn2)C(=O)NCC(O)c2ccccc2)Oc2ccccc12
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| InChI |
InChI=1S/C27H30N4O4/c1-34-24-17-27(35-23-10-6-5-9-20(23)24)13-15-31(16-14-27)25-12-11-21(29-30-25)26(33)28-18-22(32)19-7-3-2-4-8-19/h2-12,22,24,32H,13-18H2,1H3,(H,28,33)
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| InChIKey |
RJTHOZRLXMDNHA-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