In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 28 | 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) | 4.19 | 7.64 | -11.7 | 2 | 7 | 0 | 89 | 439.324 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.19 | 7.45 | -44.14 | 1 | 7 | -1 | 87 | 438.316 | 8 | ↓ |