In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 23 | 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) | 4.30 | 6.95 | -11.6 | 1 | 5 | 0 | 67 | 345.449 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.30 | 7.72 | -41.73 | 0 | 5 | -1 | 70 | 344.441 | 3 | ↓ |