In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 19 | 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) | 0.46 | 6.76 | -55.12 | 2 | 4 | 1 | 42 | 256.329 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.46 | 5.37 | -9.63 | 1 | 4 | 0 | 37 | 255.321 | 2 | ↓ |