General Information of the Compound
| Compound ID |
CP0112815
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| Compound Name |
4-ethyl-6-[5-(1,3,5-trimethylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-amine
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| Structure |
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| Formula |
C19H21N7
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| Molecular Weight |
347.426
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| Canonical SMILES |
CCc1cc(nc(N)n1)-c1c[nH]c2ncc(cc12)-c1c(C)nn(C)c1C
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| InChI |
InChI=1S/C19H21N7/c1-5-13-7-16(24-19(20)23-13)15-9-22-18-14(15)6-12(8-21-18)17-10(2)25-26(4)11(17)3/h6-9H,5H2,1-4H3,(H,21,22)(H2,20,23,24)
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| InChIKey |
YYBPZWIFCIMNCY-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