In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 26 | 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) | 3.80 | 10.54 | -57.21 | 1 | 5 | 1 | 51 | 409.988 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.80 | 8.04 | -13.15 | 0 | 5 | 0 | 49 | 408.98 | 5 | ↓ |