In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 22 | 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) | 1.41 | 5.32 | -9.23 | 0 | 7 | 0 | 66 | 305.334 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.41 | 5.81 | -31.05 | 1 | 7 | 1 | 67 | 306.342 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.