In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2004 | 30 | No |
None
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) | 3.29 | 4.4 | -11.27 | 3 | 7 | 0 | 106 | 426.835 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | 4.84 | -51.92 | 4 | 7 | 1 | 108 | 427.843 | 4 | ↓ |