In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 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) | 3.17 | 9.89 | -56.24 | 0 | 4 | -1 | 58 | 243.286 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 10.37 | -61.06 | 1 | 4 | 0 | 59 | 244.294 | 3 | ↓ |