In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 13 | 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) | 0.79 | 2.42 | -30.98 | 2 | 3 | 1 | 28 | 187.307 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.79 | 0.03 | -4.03 | 1 | 3 | 0 | 27 | 186.299 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.79 | 1.99 | -30.49 | 2 | 3 | 1 | 28 | 187.307 | 3 | ↓ |