In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 15 | 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) | 0.93 | 1.41 | -55.06 | 3 | 4 | 1 | 65 | 235.373 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.93 | 1.02 | -8.58 | 2 | 4 | 0 | 63 | 234.365 | 4 | ↓ |