| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 17 | Yes |
Popular Name: (4-amino-6,6-dimethyl-1H-s-triazin-5-ium-2-yl)-(o-tolyl)amine (4-amino-6,6-dimethyl-1H-s-triaz…
| 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) | 0.75 | 7.68 | -25.93 | 5 | 5 | 1 | 76 | 232.311 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.75 | 7.04 | -13.36 | 4 | 5 | 0 | 78 | 231.303 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.75 | 6.57 | -13.21 | 4 | 5 | 0 | 75 | 231.303 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.75 | 7.69 | -25.74 | 5 | 5 | 1 | 76 | 232.311 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.75 | 7.06 | -33.02 | 5 | 5 | 1 | 76 | 232.311 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.88 | 7.51 | -33.82 | 5 | 5 | 1 | 74 | 232.311 | 2 | ↓ |
