In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2005 | 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) | 3.91 | 8.28 | -51.2 | 1 | 3 | -1 | 52 | 305.151 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.91 | 6.31 | -7.72 | 2 | 3 | 0 | 49 | 306.159 | 4 | ↓ |