General Information of the Compound
| Compound ID |
CP0579117
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| Compound Name |
1-(cyclopropylmethyl)-4-(3-ethenyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)pyrido[2,3-d]pyrimidin-2-one
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| Structure |
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| Formula |
C25H22F2N6O2
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| Molecular Weight |
476.487
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| Canonical SMILES |
Oc1cccc(F)c1-c1nc2n(CC3CC3)c(=O)nc(N3CCn4c(C3)cnc4C=C)c2cc1F
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| InChI |
InChI=1S/C25H22F2N6O2/c1-2-20-28-11-15-13-31(8-9-32(15)20)23-16-10-18(27)22(21-17(26)4-3-5-19(21)34)29-24(16)33(25(35)30-23)12-14-6-7-14/h2-5,10-11,14,34H,1,6-9,12-13H2
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| InChIKey |
OKNYARPABMEABB-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