In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 20 | 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) | 3.98 | 8.76 | -37.09 | 2 | 2 | 1 | 26 | 292.399 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.98 | 7.68 | -5.15 | 1 | 2 | 0 | 21 | 291.391 | 4 | ↓ |