In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 2nd, 2006 | 17 | 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) | 3.12 | 8.28 | -42.6 | 1 | 3 | 1 | 25 | 241.399 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 6.05 | -6.54 | 0 | 3 | 0 | 24 | 240.391 | 6 | ↓ |