In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 28 | 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) | 2.52 | 9.22 | -13.36 | 1 | 6 | 0 | 67 | 384.455 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.52 | 9.57 | -39.66 | 2 | 6 | 1 | 69 | 385.463 | 5 | ↓ |