In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 15 | 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) | 2.37 | 6.7 | -24.77 | 3 | 3 | 1 | 43 | 208.329 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 6.43 | -3.86 | 2 | 3 | 0 | 42 | 207.321 | 4 | ↓ |