In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 18th, 2006 | 27 | 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) | 2.33 | 2.82 | -10.9 | 3 | 8 | 0 | 115 | 370.409 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.33 | 2.98 | -56.68 | 4 | 8 | 1 | 117 | 371.417 | 5 | ↓ |