| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 10 | Yes |
Popular Name: 2,4-Diaminopyrimidine-5-carbonitrile 2,4-Diaminopyrimidine-5-carbonit…
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CAS Numbers: 16462-27-4 , [16462-27-4]
"2,4-Diaminopyrimidine-5-carbonitrile, 97%"
2,4-Diamino-5-pyrimidinecarbonitrile
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -0.84 | 1.07 | -6.11 | 4 | 5 | 0 | 102 | 135.13 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.84 | 1.37 | -37.03 | 5 | 5 | 1 | 103 | 136.138 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.84 | -2.32 | -32.13 | 5 | 5 | 1 | 103 | 136.138 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
