In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 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) | 0.41 | 3.34 | -48.74 | 2 | 4 | 1 | 40 | 186.279 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 2.05 | -9.27 | 1 | 4 | 0 | 36 | 185.271 | 2 | ↓ |