In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 16 | 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) | 2.42 | 7.57 | -39.91 | 1 | 3 | 1 | 21 | 224.303 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 5.34 | -6.17 | 0 | 3 | 0 | 19 | 223.295 | 3 | ↓ |