In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 23 | Yes |
Popular Name: 2-[[(2R)-2-(5-ethyl-3-methyl-isoxazol-4-yl)pyrrolidin-1-yl]methyl]-6-methoxy-phenol 2-[[(2R)-2-(5-ethyl-3-methyl-iso…
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) | 2.70 | 8.21 | -35.64 | 2 | 5 | 1 | 60 | 317.409 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 9.01 | -39.51 | 1 | 5 | 0 | 63 | 316.401 | 5 | ↓ |