In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 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) | 2.25 | 3.32 | -23.15 | 1 | 4 | 0 | 59 | 224.285 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.60 | 3.05 | -40.41 | 0 | 4 | -1 | 61 | 223.277 | 2 | ↓ |