In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 28 | 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) | -1.55 | -0.93 | -57.63 | 10 | 12 | 1 | 194 | 409.452 | 5 | ↓ |
Hi High (pH 8-9.5) | -1.07 | -1.96 | -62.35 | 9 | 12 | 0 | 195 | 408.444 | 4 | ↓ |