In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2010 | 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) | 2.29 | 8.85 | -36.49 | 1 | 3 | 1 | 41 | 224.287 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 8.86 | -7.59 | 0 | 3 | 0 | 40 | 223.279 | 3 | ↓ |