In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2010 | 22 | 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) | 3.00 | 8.73 | -11.19 | 0 | 3 | 0 | 40 | 287.366 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 8.41 | -32.04 | 1 | 3 | 1 | 41 | 288.374 | 5 | ↓ |