In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 12th, 2007 | 34 | 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) | 3.61 | 13.02 | -55.11 | 2 | 6 | 1 | 59 | 479.67 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 10.74 | -16.28 | 1 | 6 | 0 | 58 | 478.662 | 7 | ↓ |