In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2006 | 34 | 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) | 3.51 | 8.81 | -63.2 | 0 | 9 | -1 | 118 | 459.434 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.51 | 8.06 | -15.87 | 1 | 9 | 0 | 115 | 460.442 | 6 | ↓ |