In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2005 | 27 | 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) | 3.43 | 10.57 | -12.4 | 1 | 5 | 0 | 60 | 379.847 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.43 | 11.04 | -47.75 | 2 | 5 | 1 | 61 | 380.855 | 5 | ↓ |