In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2009 | 20 | 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) | 3.06 | 3.3 | -40.14 | 0 | 5 | -1 | 70 | 311.77 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.06 | 3.29 | -9.4 | 1 | 5 | 0 | 68 | 312.778 | 5 | ↓ |