In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 14 | 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) | 2.05 | 5.14 | -30.75 | 0 | 4 | -1 | 64 | 203.612 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.05 | 5.27 | -9.31 | 1 | 4 | 0 | 65 | 204.62 | 1 | ↓ |