In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2009 | 24 | No |
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) | 4.13 | 7.95 | -46.69 | 0 | 4 | -1 | 57 | 330.392 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.13 | 8.37 | -19.11 | 1 | 4 | 0 | 55 | 331.4 | 3 | ↓ |