In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 21 | Yes |
Popular Name: [4-hydroxy-4-(hydroxymethyl)-1-piperidyl]-(2-methyl-1H-benzimidazol-4-yl)methanone [4-hydroxy-4-(hydroxymethyl)-1-p…
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) | -0.37 | 0.68 | -18.39 | 3 | 6 | 0 | 89 | 289.335 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.37 | 1.12 | -34.02 | 4 | 6 | 1 | 91 | 290.343 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.