| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 20 | Yes |
Popular Name: (3S)-1-isopropyl-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]pyrrolidin-3-amine (3S)-1-isopropyl-N-[2-([1,2,4]tr…
| 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) | 1.66 | 7.96 | -44.33 | 2 | 5 | 1 | 47 | 274.392 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 5.54 | -13.54 | 1 | 5 | 0 | 45 | 273.384 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.66 | 6.74 | -54.91 | 2 | 5 | 1 | 50 | 274.392 | 5 | ↓ |
