In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | 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) | 1.81 | 6.95 | -46.84 | 0 | 5 | -1 | 70 | 292.355 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.81 | 5.06 | -7.8 | 1 | 5 | 0 | 67 | 293.363 | 2 | ↓ |