In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2008 | 25 | Yes |
Popular Name: (2S)-N-(1,3-benzodioxol-5-yl)-2-[(2-methoxyphenyl)methyl-methyl-amino]propanamide (2S)-N-(1,3-benzodioxol-5-yl)-2-…
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) | 2.77 | 7.21 | -40.2 | 2 | 6 | 1 | 61 | 343.403 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 4.89 | -11.68 | 1 | 6 | 0 | 60 | 342.395 | 6 | ↓ |