| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 23 | Yes |
Popular Name: 2-[(7S)-2-amino-7-phenyl-6,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-3-ium-5-yl]phenol 2-[(7S)-2-amino-7-phenyl-6,7-dih…
| 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) | 2.84 | 9.46 | -27.7 | 4 | 6 | 1 | 91 | 306.349 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.84 | 9.73 | -58.1 | 2 | 6 | -1 | 92 | 304.333 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.85 | 9.74 | -26.48 | 5 | 6 | 1 | 94 | 306.349 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.84 | 8.96 | -15.45 | 3 | 6 | 0 | 89 | 305.341 | 2 | ↓ |
