In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 16 | 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) | 2.77 | 5.86 | -7.05 | 1 | 2 | 0 | 25 | 236.677 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.77 | 6.26 | -36.47 | 2 | 2 | 1 | 26 | 237.685 | 3 | ↓ |