In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 20 | 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) | 2.10 | 5.58 | -7.98 | 1 | 4 | 0 | 43 | 290.436 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 7.18 | -36.97 | 2 | 4 | 1 | 47 | 291.444 | 4 | ↓ |