General Information of the Compound
| Compound ID |
CP0465280
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| Compound Name |
2-[2,5,6-Trimethyl-7-(2,4,6-trimethyl-phenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino]-butan-1-ol
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| Structure |
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| Formula |
C22H30N4O
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| Molecular Weight |
366.509
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| Canonical SMILES |
CCC(CO)Nc1nc(C)nc2n(c(C)c(C)c12)-c1c(C)cc(C)cc1C
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| InChI |
InChI=1S/C22H30N4O/c1-8-18(11-27)25-21-19-15(5)16(6)26(22(19)24-17(7)23-21)20-13(3)9-12(2)10-14(20)4/h9-10,18,27H,8,11H2,1-7H3,(H,23,24,25)
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| InChIKey |
ZLBWRKDGEWTLOL-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