In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 21 | 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) | 2.70 | 8.51 | -49.54 | 3 | 3 | 1 | 45 | 278.379 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.70 | 8.97 | -101.46 | 4 | 3 | 2 | 47 | 279.387 | 2 | ↓ |