In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 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) | 1.27 | 0.86 | -13.87 | 1 | 5 | 0 | 59 | 237.255 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.27 | 1.7 | -55.7 | 0 | 5 | -1 | 62 | 236.247 | 2 | ↓ |