In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 19 | Yes |
Popular Name: (2S)-2-amino-N-(1,3-benzodioxol-5-ylmethyl)-3,3-dimethyl-butanamide (2S)-2-amino-N-(1,3-benzodioxol-…
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) | 1.27 | 2.72 | -45.73 | 4 | 5 | 1 | 75 | 265.333 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.27 | 2.39 | -8.74 | 3 | 5 | 0 | 74 | 264.325 | 4 | ↓ |