In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2005 | 20 | No |
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) | 0.96 | -2.65 | -7.63 | 2 | 5 | 0 | 71 | 289.722 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.96 | -2.54 | -38.88 | 3 | 5 | 1 | 72 | 290.73 | 4 | ↓ |