In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 4th, 2010 | 19 | 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) | 2.26 | 8.74 | -16.12 | 0 | 4 | 0 | 38 | 259.353 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 9.15 | -30.59 | 1 | 4 | 1 | 39 | 260.361 | 5 | ↓ |