In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2009 | 11 | 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) | 0.81 | 3.59 | -37.93 | 2 | 3 | 1 | 34 | 154.237 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.81 | 2.38 | -4.97 | 1 | 3 | 0 | 30 | 153.229 | 3 | ↓ |