2,4-Diaminopyrimidine
PubChem CID: 67431
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| Compound Synonyms | 2,4-Diaminopyrimidine, 156-81-0, PYRIMIDINE-2,4-DIAMINE, 2,4-Pyrimidinediamine, 2,6-Diaminopyrimidine, Pyrimidine, 2,4-diamino-, Diaminopyrimidine, Pyrimidine-2,4-diyldiamine, L5ZY0JJP5J, 2,4-diamino-pyrimidine, EINECS 205-862-3, MFCD00038023, NSC 30856, NSC-30856, DTXSID70166021, LG3, cytosine imine, 8-azacytosine, 2,4-Pyrimidinediamine (9CI), 2,4-pyrmidinediamine, Pyrimidine,4-diamino-, Iminodihydropyrimidinimine, UNII-L5ZY0JJP5J, Pyrimidine, 2,4-diamine, SCHEMBL53016, WLN: T6N CNJ BZ DZ, 2,4-Diaminopyrimidine, 98%, 2,4-diaminopyrimidine-3n-oxide, CHEMBL1233987, DTXCID3088512, SCHEMBL12500595, SCHEMBL18583192, CHEBI:43745, NSC30856, BDBM50542901, AKOS009156371, 2,4-Diaminopyrimidine, technical grade, CS-W005124, PS-4817, SB57571, SY014486, DB-011590, D2120, NS00025098, EN300-154949, Q209196, Z856211450 |
|---|---|
| Topological Polar Surface Area | 77.8 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 8.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 74.4 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P00374 |
| Iupac Name | pyrimidine-2,4-diamine |
| Prediction Hob | 1.0 |
| Target Id | NPT2818 |
| Xlogp | -0.5 |
| Molecular Formula | C4H6N4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | YAAWASYJIRZXSZ-UHFFFAOYSA-N |
| Fcsp3 | 0.0 |
| Logs | -1.444 |
| Rotatable Bond Count | 0.0 |
| Logd | -1.483 |
| Compound Name | 2,4-Diaminopyrimidine |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 110.059 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 110.059 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 110.12 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.211744 |
| Inchi | InChI=1S/C4H6N4/c5-3-1-2-7-4(6)8-3/h1-2H,(H4,5,6,7,8) |
| Smiles | C1=CN=C(N=C1N)N |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Cephalotaxus Fortunei (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all