General Information of the Compound
| Compound ID |
CP0571496
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| Compound Name |
US9206173, 2465
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| Structure |
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| Formula |
C25H24F3N5O4
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| Molecular Weight |
515.492
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| Canonical SMILES |
COn1c(NC(C)c2ccc(cc2)C(F)(F)F)nc2CCN(Cc2c1=O)C(=O)c1cc2occc2n1C
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| InChI |
InChI=1S/C25H24F3N5O4/c1-14(15-4-6-16(7-5-15)25(26,27)28)29-24-30-18-8-10-32(13-17(18)22(34)33(24)36-3)23(35)20-12-21-19(31(20)2)9-11-37-21/h4-7,9,11-12,14H,8,10,13H2,1-3H3,(H,29,30)
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| InChIKey |
YCSGFSXXQNVBQD-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