In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 14 | 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) | 2.12 | 6.29 | -99.93 | 3 | 2 | 2 | 21 | 198.354 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 3.74 | -39.27 | 2 | 2 | 1 | 20 | 197.346 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 4.87 | -33.77 | 2 | 2 | 1 | 16 | 197.346 | 3 | ↓ |