In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 20 | 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) | 2.55 | 3.96 | -9.13 | 2 | 3 | 0 | 46 | 306.818 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.55 | 6.19 | -31.59 | 3 | 3 | 1 | 48 | 307.826 | 3 | ↓ |