In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 17 | 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) | 0.97 | 1.61 | -42.19 | 4 | 5 | 1 | 80 | 240.327 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.97 | 0.49 | -15.05 | 3 | 5 | 0 | 75 | 239.319 | 3 | ↓ |