General Information of the Compound
| Compound ID |
CP0127618
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| Compound Name |
1-[4-[7-(7-hydroxynaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one
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| Structure |
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| Formula |
C24H25N5O2
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| Molecular Weight |
415.497
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| Canonical SMILES |
Oc1ccc2cccc(N3CCc4c(C3)ncnc4N3CCN(CC3)C(=O)C=C)c2c1
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| InChI |
InChI=1S/C24H25N5O2/c1-2-23(31)27-10-12-28(13-11-27)24-19-8-9-29(15-21(19)25-16-26-24)22-5-3-4-17-6-7-18(30)14-20(17)22/h2-7,14,16,30H,1,8-13,15H2
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| InChIKey |
OXCJEOQZAFLZFZ-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