In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2004 | 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) | 2.89 | 6.24 | -12.17 | 1 | 4 | 0 | 39 | 293.317 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.89 | 6.34 | -28.12 | 2 | 4 | 1 | 40 | 294.325 | 3 | ↓ |