In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 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) | 1.09 | 4.01 | -39.53 | 3 | 3 | 1 | 46 | 195.286 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.09 | 2.73 | -11.58 | 2 | 3 | 0 | 41 | 194.278 | 4 | ↓ |