In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2008 | 18 | 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) | 2.24 | 3.84 | -92.53 | 0 | 5 | -2 | 88 | 310.158 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 3.76 | -52.86 | 1 | 5 | -1 | 86 | 311.166 | 6 | ↓ |