General Information of the Compound
| Compound ID |
CP0256854
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| Compound Name |
US9765054, Compound 56d
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| Structure |
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| Formula |
C21H24N2O2
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| Molecular Weight |
336.435
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| Canonical SMILES |
CC1(C)CN(C1)c1ccc(cc1)[C@H]1[C@@H]([C@@H]1c1ccccc1)C(=O)NO
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| InChI |
InChI=1S/C21H24N2O2/c1-21(2)12-23(13-21)16-10-8-15(9-11-16)18-17(19(18)20(24)22-25)14-6-4-3-5-7-14/h3-11,17-19,25H,12-13H2,1-2H3,(H,22,24)/t17-,18-,19-/m1/s1
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| InChIKey |
YSGJDZUBEJPAQY-GUDVDZBRSA-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