In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 13th, 2008 | 19 | 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) | 3.48 | 8.38 | -53.39 | 0 | 3 | -1 | 49 | 255.293 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 117-119° | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.