In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 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) | 0.01 | -3.11 | -25.82 | 4 | 7 | 0 | 119 | 274.298 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.01 | -2.04 | -70.05 | 3 | 7 | -1 | 122 | 273.29 | 5 | ↓ |