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Structure
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| Relationships |
Total Number of functionally related protein(s) :
27
Total Number of Articles : 18
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| PubChem |
9822610
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| Molecular Formula |
C21H22N6O3 |
| SMILES |
CC1=C2C=CC(=CC2=NN1)NC3=NC(=NC=C3)NC4=CC(=C(C(=C4)OC)OC)OC |
| InChI |
InChI=1S/C21H22N6O3/c1-12-15-6-5-13(9-16(15)27-26-12)23-19-7-8-22-21(25-19)24-14-10-17(28-2)20(30-4)18(11-14)29-3/h5-11H,1-4H3,(H,26,27)(H2,22,23,24,25) |
| synonyms |
- GW612286X
- N~4~-(3-Methyl-1h-Indazol-6-Yl)-N~2~-(3,4,5-Trimethoxyphenyl)pyrimidine-2,4-Diamine
- pyrimidine, 5a
- 3cjf
- SAV
- CHEMBL479079
- SCHEMBL21067484
- BDBM26479
- 4o78
- GLXC-25330
- HMS3303E14
- HMS3305P05
- NSC756278
- DB08519
- GW-612286X
- NSC-756278
- 4-N-(3-methyl-1H-indazol-6-yl)-2-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
- NCGC00242081-01
- NS00069902
- AB01092211-01
- Q27097718
- n4-(3-methyl-1h-indazol-6-yl)-n2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
- N4-(3-Methyl-2H-indazol-6-yl)-N2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
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| Properties |
| Property |
Value |
| MW |
406.4 g/mol |
| HBD |
3 |
| HBA |
8 |
| Rotatable Bond Count |
7 |
| Exact Mass |
406.17533859 g/mol |
| Monoisotopic Mass |
406.17533859 g/mol |
| Heavy Atom Count |
30 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
529 |
| xlogp |
3.9 |
| Topological Polar Surface Area |
106 |
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