| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 22 | Yes |
Popular Name: 5-methyl-2-[(3S)-1-(2-pyridylmethyl)pyrrolidin-3-yl]-1,3-benzoxazole 5-methyl-2-[(3S)-1-(2-pyridylmet…
| 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) | 2.75 | 4.51 | -9.85 | 0 | 4 | 0 | 42 | 293.37 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.75 | 5.05 | -36.48 | 1 | 4 | 1 | 43 | 294.378 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.75 | 6.93 | -40.79 | 1 | 4 | 1 | 43 | 294.378 | 3 | ↓ |
