In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 22 | 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) | 2.12 | 7.19 | -14.04 | 1 | 7 | 0 | 82 | 300.318 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 5.84 | -41.64 | 0 | 7 | -1 | 85 | 299.31 | 5 | ↓ |