In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 23 | 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) | 5.16 | 12.97 | -11.62 | 0 | 2 | 0 | 18 | 300.405 | 2 | ↓ |
Mid Mid (pH 6-8) | 5.16 | 13.41 | -31.34 | 1 | 2 | 1 | 19 | 301.413 | 2 | ↓ |