In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 18 | 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) | 1.90 | 5.69 | -8.16 | 1 | 4 | 0 | 49 | 243.31 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.90 | 6.15 | -30.18 | 2 | 4 | 1 | 50 | 244.318 | 2 | ↓ |