Common name
5-methylpyrimidin-4-amine
IUPAC name
5-methylpyrimidin-4-amine
SMILES
n1cc(c(nc1)N)C
Common name
5-methylpyrimidin-4-amine
IUPAC name
5-methylpyrimidin-4-amine
SMILES
n1cc(c(nc1)N)C
INCHI
InChI=1S/C5H7N3/c1-4-2-7-3-8-5(4)6/h2-3H,1H3,(H2,6,7,8)
FORMULA
C5H7N3
Common name
5-methylpyrimidin-4-amine
IUPAC name
5-methylpyrimidin-4-amine
Molecular weight
109.129
clogP
0.685
clogS
-1.313
Frequency
0.0003
HBond Acceptor
2
HBond Donor
2
Total PolarSurface Area
51.8
Number of Rings
1
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD00177 | Bleomycin |
|
Antineoplastic Agents; Immunosuppressive Agents; Antibiotics, Antineoplastic; Antineoplastic and Immunomodulating Agents; Cytotoxic Antibiotics and Related Substances; | For palliative treatment in the management malignant neoplasm (trachea, bronchus, lung), squamous cell carcinoma, and lymphomas. |
1 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4o76_ligand_1_3.mol2 | 4o76 | 1 | -6.20 | c1(ncncc1C)N | 8 |
| 4ogj_ligand_1_6.mol2 | 4ogj | 1 | -6.20 | c1nc(c(cn1)C)N | 8 |
| 4ps5_ligand_1_6.mol2 | 4ps5 | 1 | -6.15 | c1nc(c(cn1)C)N | 8 |
| 4pov_ligand_1_2.mol2 | 4pov | 0.820513 | -7.23 | c1(nc(ncc1C)C)N | 9 |
| 4pop_ligand_1_2.mol2 | 4pop | 0.820513 | -7.19 | c1(nc(ncc1C)C)N | 9 |
| 1olu_ligand_1_0.mol2 | 1olu | 0.820513 | -6.88 | Cc1c(nc(nc1)C)N | 9 |
154 ,
16
