General Information of the Compound
| Compound ID |
CP0912662
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| Compound Name |
SID131448213
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| Structure |
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| Formula |
C24H27FN2O2
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| Molecular Weight |
394.49
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| Canonical SMILES |
CN(C[C@H]1N[C@@H](CO)[C@@H]1c1ccc(C2=CCCC2)cc1)C(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C24H27FN2O2/c1-27(24(29)19-10-12-20(25)13-11-19)14-21-23(22(15-28)26-21)18-8-6-17(7-9-18)16-4-2-3-5-16/h4,6-13,21-23,26,28H,2-3,5,14-15H2,1H3/t21-,22+,23-/m1/s1
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| InChIKey |
VWMYDVMZMRKXLX-XPWALMASSA-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