In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2009 | 14 | 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) | 2.15 | 4.75 | -10.68 | 1 | 3 | 0 | 54 | 192.214 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.15 | 5.84 | -48.71 | 0 | 3 | -1 | 57 | 191.206 | 3 | ↓ |