In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2004 | 35 | 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) | 5.88 | 12.73 | -15.85 | 1 | 7 | 0 | 83 | 518.031 | 10 | ↓ |
Hi High (pH 8-9.5) | 6.07 | 10.89 | -46 | 0 | 7 | -1 | 89 | 517.023 | 10 | ↓ |