In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 8th, 2007 | 24 | 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) | 2.23 | -4.68 | -12.99 | 1 | 6 | 0 | 71 | 342.424 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.23 | -4.59 | -38.69 | 2 | 6 | 1 | 72 | 343.432 | 4 | ↓ |