In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 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) | 5.09 | 12.17 | -6.68 | 2 | 3 | 0 | 44 | 299.805 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.09 | 12.65 | -26.5 | 3 | 3 | 1 | 45 | 300.813 | 4 | ↓ |