In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 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) | 2.40 | 9.99 | -54.76 | 0 | 4 | -1 | 57 | 251.265 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 10.43 | -57.9 | 1 | 4 | 0 | 59 | 252.273 | 3 | ↓ |