In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 4th, 2011 | 27 | 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) | 2.94 | 3.82 | -46.68 | 0 | 7 | -1 | 93 | 430.234 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.49 | 6.26 | -10.21 | 1 | 7 | 0 | 90 | 431.242 | 4 | ↓ |