In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2009 | 29 | 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) | 2.86 | 9.59 | -50.64 | 2 | 6 | 1 | 57 | 399.559 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.86 | 7.22 | -19.94 | 1 | 6 | 0 | 56 | 398.551 | 5 | ↓ |