In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 13 | No |
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) | 0.82 | 4.24 | -40.97 | 2 | 3 | 1 | 34 | 205.709 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.00 | 2.41 | -32.36 | 1 | 3 | 0 | 40 | 204.701 | 4 | ↓ |