In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 26 | 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) | 3.97 | 12.85 | -57.59 | 1 | 4 | 1 | 39 | 388.944 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.97 | 10.41 | -13.91 | 0 | 4 | 0 | 38 | 387.936 | 4 | ↓ |