In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2009 | 26 | 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) | 3.92 | 9.83 | -45.91 | 1 | 4 | 1 | 42 | 391.944 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.92 | 7.68 | -8.11 | 0 | 4 | 0 | 41 | 390.936 | 3 | ↓ |