In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 4th, 2006 | 21 | 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) | -0.97 | 6.62 | -112.71 | 1 | 7 | -2 | 119 | 293.275 | 8 | ↓ |
Lo Low (pH 4.5-6) | -0.97 | 4.64 | -51.24 | 2 | 7 | -1 | 116 | 294.283 | 8 | ↓ |