In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2011 | 21 | Yes |
Popular Name: N,N-dimethyl-1-[1-[2-(1-piperidyl)ethyl]benzimidazol-2-yl]methanamine N,N-dimethyl-1-[1-[2-(1-piperidy…
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) | 2.34 | 10.6 | -111.35 | 2 | 4 | 2 | 27 | 288.439 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.34 | 6.22 | -6.52 | 0 | 4 | 0 | 24 | 286.423 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.34 | 8.43 | -45.9 | 1 | 4 | 1 | 26 | 287.431 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.