In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2009 | 31 | 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) | -2.81 | -7.6 | -158.82 | 10 | 10 | 3 | 155 | 448.581 | 18 | ↓ |
Hi High (pH 8-9.5) | -2.81 | -8.28 | -91.73 | 9 | 10 | 2 | 154 | 447.573 | 18 | ↓ |
Mid Mid (pH 6-8) | -2.81 | -6.72 | -88.83 | 9 | 10 | 2 | 158 | 447.573 | 18 | ↓ |