In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 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) | 3.94 | 8.72 | -50.49 | 1 | 4 | -1 | 61 | 282.319 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.94 | 6.73 | -7.88 | 2 | 4 | 0 | 59 | 283.327 | 7 | ↓ |