In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 17 | 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) | 1.06 | 0.87 | -6.14 | 1 | 4 | 0 | 42 | 237.299 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.06 | 3.25 | -43.92 | 2 | 4 | 1 | 43 | 238.307 | 4 | ↓ |