In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 32 | No |
None
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) | 4.10 | 10.38 | -13.38 | 0 | 6 | 0 | 61 | 426.472 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.10 | 13.21 | -55.68 | 1 | 6 | 1 | 62 | 427.48 | 4 | ↓ |