In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 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) | 2.59 | 7.07 | -13.64 | 0 | 3 | 0 | 39 | 241.29 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.59 | 7.51 | -38.88 | 1 | 3 | 1 | 40 | 242.298 | 4 | ↓ |