In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 12 | 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) | 2.56 | 4.41 | -32.91 | 2 | 2 | 1 | 26 | 172.292 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.56 | 3.33 | -1.63 | 1 | 2 | 0 | 21 | 171.284 | 3 | ↓ |