In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 17 | 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) | 3.22 | 7.45 | -36.8 | 2 | 3 | 1 | 37 | 241.399 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.22 | 6.15 | -7.34 | 1 | 3 | 0 | 32 | 240.391 | 7 | ↓ |