In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2006 | 21 | 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) | 4.95 | 7.46 | -8.75 | 1 | 3 | 0 | 45 | 278.355 | 2 | ↓ |
Hi High (pH 8-9.5) | 5.40 | 5.7 | -47.88 | 0 | 3 | -1 | 48 | 277.347 | 2 | ↓ |