In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 21 | 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) | 3.86 | 11.4 | -41.63 | 2 | 1 | 1 | 17 | 278.419 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.86 | 10.6 | -3.02 | 1 | 1 | 0 | 12 | 277.411 | 2 | ↓ |