General Information of the Compound
| Compound ID |
CP0908041
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| Compound Name |
SID144190778
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| Formula |
C26H24FN3O
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| Molecular Weight |
413.496
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| Canonical SMILES |
O=C(Nc1ccc(F)cc1)N1C[C@@H]2N[C@H](C1)[C@@H]2c1ccc(/C=C/c2ccccc2)cc1
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| InChI |
InChI=1S/C26H24FN3O/c27-21-12-14-22(15-13-21)28-26(31)30-16-23-25(24(17-30)29-23)20-10-8-19(9-11-20)7-6-18-4-2-1-3-5-18/h1-15,23-25,29H,16-17H2,(H,28,31)/b7-6+/t23-,24+,25+
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| InChIKey |
NDHGURROAMTUNH-SOTXCSMQSA-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