In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2005 | 29 | 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) | 2.29 | 1.52 | -12.4 | 4 | 8 | 0 | 126 | 390.399 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.29 | 1.94 | -61.08 | 5 | 8 | 1 | 128 | 391.407 | 4 | ↓ |