In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2009 | 17 | 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) | 1.00 | 2.51 | -50.16 | 3 | 4 | 1 | 49 | 232.307 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.00 | 1.1 | -7.81 | 2 | 4 | 0 | 44 | 231.299 | 1 | ↓ |