In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 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) | 3.36 | 14.84 | -49.56 | 1 | 5 | 1 | 40 | 368.53 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.36 | 13.03 | -22.24 | 0 | 5 | 0 | 38 | 367.522 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.