In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 26th, 2009 | 17 | 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) | 1.76 | 1.71 | -15.52 | 2 | 5 | 0 | 75 | 256.327 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.76 | 1.79 | -49.67 | 1 | 5 | -1 | 77 | 255.319 | 5 | ↓ |