In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 19 | 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) | 3.17 | 6.32 | -52.51 | 3 | 4 | -1 | 78 | 275.715 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 6.18 | -66.65 | 4 | 4 | 0 | 80 | 276.723 | 4 | ↓ |