In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2013 | 22 | Yes |
Popular Name: 4-[2-(Hydroxymethyl)-1H-benzoimidazol-1-yl]butylPivalate 4-[2-(Hydroxymethyl)-1H-benzoimi…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 462066-61-1 , 797032-02-1
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) | 3.05 | 7.65 | -15.21 | 1 | 5 | 0 | 64 | 304.39 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.05 | 8.34 | -32.23 | 2 | 5 | 1 | 66 | 305.398 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.