In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 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) | 2.55 | 7.08 | -4.44 | 1 | 2 | 0 | 25 | 238.334 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.55 | 7.53 | -34.58 | 2 | 2 | 1 | 26 | 239.342 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.55 | 8.12 | -47.53 | 2 | 2 | 1 | 29 | 239.342 | 3 | ↓ |