In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 18 | 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) | 1.92 | 0.93 | -55.06 | 1 | 5 | -1 | 82 | 269.346 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.29 | 2.54 | -12.57 | 2 | 5 | 0 | 75 | 270.354 | 3 | ↓ |