General Information of the Compound
| Compound ID |
CP0419636
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| Compound Name |
US9340500, I-007
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| Structure |
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| Formula |
C20H24F3N3O2
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| Molecular Weight |
395.425
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| Canonical SMILES |
Cc1c(ccn1CCCN1CCOCC1)C(=O)Nc1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C20H24F3N3O2/c1-15-18(6-9-26(15)8-3-7-25-10-12-28-13-11-25)19(27)24-17-5-2-4-16(14-17)20(21,22)23/h2,4-6,9,14H,3,7-8,10-13H2,1H3,(H,24,27)
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| InChIKey |
QQDGNGDGTFIHID-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