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) | 1.10 | 2.83 | -48.71 | 3 | 4 | 1 | 49 | 265.377 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.10 | 5.16 | -92.58 | 4 | 4 | 2 | 51 | 266.385 | 7 | ↓ |