In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2005 | 27 | 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) | 6.97 | 13.93 | -8.85 | 1 | 3 | 0 | 29 | 361.533 | 4 | ↓ |
Mid Mid (pH 6-8) | 6.97 | 14.37 | -23.71 | 2 | 3 | 1 | 31 | 362.541 | 4 | ↓ |