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Structure
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|
| Relationships |
Total Number of functionally related protein(s) :
9
Total Number of Articles : 8
|
| PubChem |
60167849
|
| Molecular Formula |
C23H24N6 |
| SMILES |
CC1=CN=C(N=C1NCC2=CC=C(C=C2)N3C=CN=N3)C4=CC=CC=C4C(C)C |
| InChI |
InChI=1S/C23H24N6/c1-16(2)20-6-4-5-7-21(20)23-24-14-17(3)22(27-23)25-15-18-8-10-19(11-9-18)29-13-12-26-28-29/h4-14,16H,15H2,1-3H3,(H,24,25,27) |
| synonyms |
- ML323
- ML-323
- ML 323
- 5-methyl-2-(2-propan-2-ylphenyl)-N-[[4-(triazol-1-yl)phenyl]methyl]pyrimidin-4-amine
- 5-methyl-2-(2-propan-2-ylphenyl)-N-((4-(triazol-1-yl)phenyl)methyl)pyrimidin-4-amine
- 1572414-83-5
- N-(4-(1H-1,2,3-triazol-1-yl)benzyl)-2-(2-isopropylphenyl)-5-methylpyrimidin-4-amine
- 2-(2-ISOPROPYLPHENYL)-5-METHYL-N-{[4-(1,2,3-TRIAZOL-1-YL)PHENYL]METHYL}PYRIMIDIN-4-AMINE
- CHEMBL3182437
- 5-methyl-2-(2-propan-2-ylphenyl)-~{N}-[[4-(1,2,3-triazol-1-yl)phenyl]methyl]pyrimidin-4-amine
- 5-methyl-2-[2-(propan-2-yl)phenyl]-N-{[4-(1H-1,2,3-triazol-1-yl)phenyl]methyl}pyrimidin-4-amine
- JDA
- MFCD28099817
- GTPL7898
- SCHEMBL15847799
- EX-A392
- GLXC-04121
- HMS3653L13
- HMS3743A15
- BCP09653
- BDBM50069762
- s7529
- AKOS026750196
- CCG-268461
- ML-323?
- SB19053
- NCGC00262306-01
- NCGC00262306-02
- NCGC00262306-24
- NCGC00262306-25
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| Properties |
| Property |
Value |
| MW |
384.5 g/mol |
| HBD |
1 |
| HBA |
5 |
| Rotatable Bond Count |
6 |
| Exact Mass |
384.20624479 g/mol |
| Monoisotopic Mass |
384.20624479 g/mol |
| Heavy Atom Count |
29 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
492 |
| xlogp |
4.6 |
| Topological Polar Surface Area |
68.5 |
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