In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 25 | 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) | 1.80 | 6.76 | -20.88 | 1 | 7 | 0 | 90 | 355.423 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.80 | 6.54 | -33.96 | 2 | 7 | 1 | 91 | 356.431 | 3 | ↓ |