In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 15 | Yes |
Popular Name: (2S)-2-amino-2-(8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)acetonitrile (2S)-2-amino-2-(8-chloro-2,3-dih…
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) | -0.48 | 2.26 | -9.76 | 2 | 4 | 0 | 68 | 224.647 | 1 | ↓ |
Lo Low (pH 4.5-6) | -0.48 | 2.62 | -59.82 | 3 | 4 | 1 | 70 | 225.655 | 1 | ↓ |