In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 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) | 2.80 | 4.5 | -14.82 | 2 | 4 | 0 | 62 | 225.251 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 5.37 | -46.29 | 1 | 4 | -1 | 65 | 224.243 | 1 | ↓ |