In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2009 | 26 | Yes |
Popular Name: (3S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-N-(3-pyridylmethyl)pyrrolidine-3-carboxamide (3S)-1-(2,3-dihydro-1,4-benzodio…
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) | 0.18 | 5.03 | -22.94 | 1 | 7 | 0 | 81 | 353.378 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.18 | 5.47 | -56.53 | 2 | 7 | 1 | 82 | 354.386 | 4 | ↓ |