In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 9 | 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) | 1.14 | 2.21 | -36.15 | 2 | 2 | 1 | 26 | 130.211 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.14 | 0.89 | -2.3 | 1 | 2 | 0 | 21 | 129.203 | 1 | ↓ |