In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 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) | 3.78 | 7.42 | -8.28 | 1 | 2 | 0 | 33 | 253.326 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.24 | 5.45 | -45.97 | 0 | 2 | -1 | 36 | 252.318 | 2 | ↓ |