In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 19 | 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) | 3.63 | 10.32 | -55.5 | 0 | 4 | -1 | 58 | 316.134 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.63 | 10.8 | -56.51 | 1 | 4 | 0 | 59 | 317.142 | 2 | ↓ |