In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 14 | 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) | 0.92 | 0.58 | -51.3 | 5 | 3 | 1 | 64 | 195.217 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.92 | 1.32 | -76.01 | 4 | 3 | 0 | 66 | 194.209 | 2 | ↓ |