In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2010 | 23 | Yes |
Popular Name: 3-acetamido-N-[(2S)-2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]propanamide 3-acetamido-N-[(2S)-2-(1,3-benzo…
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) | 0.34 | 3.2 | -57.97 | 3 | 7 | 1 | 81 | 322.385 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.34 | 0.65 | -19.66 | 2 | 7 | 0 | 80 | 321.377 | 7 | ↓ |