In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (2S)-3-[(6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)-methyl-amino]-2-methyl-propanenitrile (2S)-3-[(6-amino-2,3-dihydro-1,4…
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) | 1.49 | 4.68 | -8.94 | 2 | 5 | 0 | 72 | 247.298 | 3 | ↓ |