General Information of the Compound
| Compound ID |
CP0414565
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| Compound Name |
US9278960, 7-37
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| Structure |
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| Formula |
C23H20FN5O
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| Molecular Weight |
401.445
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| Canonical SMILES |
Cn1cc(cn1)-c1cc(nc2c(F)c(Cc3ccc(nc3)C3CC3)ccc12)C(N)=O
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| InChI |
InChI=1S/C23H20FN5O/c1-29-12-16(11-27-29)18-9-20(23(25)30)28-22-17(18)6-5-15(21(22)24)8-13-2-7-19(26-10-13)14-3-4-14/h2,5-7,9-12,14H,3-4,8H2,1H3,(H2,25,30)
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| InChIKey |
JWRVZDCQNNKRSK-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