In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 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) | 1.78 | 4.41 | -8.64 | 1 | 4 | 0 | 52 | 259.305 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.78 | 4.87 | -37.27 | 2 | 4 | 1 | 53 | 260.313 | 6 | ↓ |