In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 28th, 2006 | 36 | 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) | 1.61 | 4.51 | -61.42 | 6 | 13 | -1 | 201 | 498.52 | 10 | ↓ |
Lo Low (pH 4.5-6) | 1.61 | 4.88 | -72.71 | 7 | 13 | 0 | 202 | 499.528 | 10 | ↓ |