In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2005 | 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) | 3.68 | 5.61 | -8.28 | 2 | 3 | 0 | 45 | 250.729 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.75 | 2.68 | -6.72 | 2 | 3 | 0 | 48 | 250.729 | 4 | ↓ |