In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2008 | 12 | 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) | 0.70 | 5.57 | -39.42 | 1 | 3 | 1 | 25 | 171.264 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 3.5 | -7.31 | 0 | 3 | 0 | 24 | 170.256 | 1 | ↓ |