General Information of the Compound
| Compound ID |
CP0566945
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| Compound Name |
4-methyl-1-[4-[7-(3-morpholin-4-ylpropyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-yl]phenyl]piperazin-2-one
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| Structure |
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| Formula |
C24H32N6O2
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| Molecular Weight |
436.56
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| Canonical SMILES |
CN1CCN(C(=O)C1)c1ccc(cc1)-c1ncc2CCN(CCCN3CCOCC3)c2n1
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| InChI |
InChI=1S/C24H32N6O2/c1-27-11-12-30(22(31)18-27)21-5-3-19(4-6-21)23-25-17-20-7-10-29(24(20)26-23)9-2-8-28-13-15-32-16-14-28/h3-6,17H,2,7-16,18H2,1H3
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| InChIKey |
MFMKTDZALVDFAC-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