In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 16 | 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) | -0.46 | 2.93 | -53.3 | 4 | 4 | 1 | 81 | 218.28 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.46 | 2.6 | -15.09 | 3 | 4 | 0 | 79 | 217.272 | 5 | ↓ |