In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2010 | 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) | 1.76 | 4.11 | -39.36 | 3 | 2 | 1 | 37 | 194.298 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.76 | 2.7 | -3.47 | 2 | 2 | 0 | 32 | 193.29 | 4 | ↓ |