In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 14 | 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) | 0.27 | 4.75 | -106.45 | 3 | 4 | 1 | 61 | 199.274 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.27 | 3.47 | -65.12 | 2 | 4 | 0 | 57 | 198.266 | 4 | ↓ |