General Information of the Compound
| Compound ID |
CP0565353
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| Compound Name |
7-[3,5-dimethoxy-N-[2-(propan-2-ylamino)ethyl]anilino]-3-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrido[1,2-a]pyrimidin-4-one
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| Formula |
C30H39N7O4
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| Molecular Weight |
561.687
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| Canonical SMILES |
COc1cc(OC)cc(c1)N(CCNC(C)C)c1ccc2ncc(-c3cnn(CCN4CCOCC4)c3)c(=O)n2c1
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| InChI |
InChI=1S/C30H39N7O4/c1-22(2)31-7-8-36(25-15-26(39-3)17-27(16-25)40-4)24-5-6-29-32-19-28(30(38)37(29)21-24)23-18-33-35(20-23)10-9-34-11-13-41-14-12-34/h5-6,15-22,31H,7-14H2,1-4H3
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| InChIKey |
YOUNPDQBMURDIT-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