In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2009 | 34 | 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) | 5.22 | 13.29 | -48.83 | 2 | 4 | 1 | 37 | 476.538 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.22 | 11.13 | -9.98 | 1 | 4 | 0 | 36 | 475.53 | 5 | ↓ |