In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 25th, 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) | 3.39 | 7.39 | -12.44 | 1 | 4 | 0 | 59 | 302.399 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 7.45 | -47.08 | 0 | 4 | -1 | 61 | 301.391 | 3 | ↓ |