In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 15 | 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) | -0.30 | 5 | -14.07 | 1 | 3 | 0 | 50 | 205.188 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.00 | 5.06 | -48.74 | 0 | 3 | -1 | 53 | 204.18 | 1 | ↓ |