In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2005 | 24 | 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) | 5.41 | 0.61 | -7.77 | 0 | 2 | 0 | 16 | 330.353 | 1 | ↓ |
Lo Low (pH 4.5-6) | 5.41 | 0.66 | -24.8 | 1 | 2 | 1 | 17 | 331.361 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.