In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 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) | 1.21 | 3.48 | -36.31 | 2 | 3 | 1 | 34 | 196.27 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.21 | 0.84 | -5.62 | 1 | 3 | 0 | 33 | 195.262 | 4 | ↓ |