In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 21 | 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) | -0.12 | 2.41 | -108.72 | 6 | 6 | 2 | 90 | 312.439 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.12 | -0.04 | -61.08 | 5 | 6 | 1 | 89 | 311.431 | 6 | ↓ |