In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 18 | 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) | 1.31 | 1.12 | -43.52 | 2 | 5 | -1 | 87 | 282.732 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.31 | 1.57 | -45.65 | 3 | 5 | 0 | 88 | 283.74 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.31 | 1.04 | -9.44 | 3 | 5 | 0 | 85 | 283.74 | 3 | ↓ |