In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 38 | 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) | 2.15 | 8.72 | -42.76 | 4 | 10 | 1 | 144 | 540.674 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.15 | 6.76 | -9.84 | 3 | 10 | 0 | 143 | 539.666 | 10 | ↓ |