In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 7th, 2008 | 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) | 1.43 | 1.4 | -5.19 | 1 | 4 | 0 | 42 | 243.347 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 3.79 | -40.25 | 2 | 4 | 1 | 43 | 244.355 | 5 | ↓ |