In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 26 | No |
None
None
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) | 0.36 | 12.53 | -28.11 | 1 | 3 | 1 | 33 | 367.538 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.36 | 13.01 | -34.9 | 1 | 3 | 0 | 33 | 366.53 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.