In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 21 | Yes |
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 | 5.93 | -50.16 | 3 | 4 | 1 | 53 | 286.399 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.27 | 6.38 | -99.38 | 4 | 4 | 2 | 54 | 287.407 | 4 | ↓ |