In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2011 | 20 | Yes |
Popular Name: N-[2-[(3S)-1-[(2-methyl-1H-imidazol-4-yl)methyl]-3-piperidyl]ethyl]methanesulfonamide N-[2-[(3S)-1-[(2-methyl-1H-imida…
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) | 0.26 | 3.74 | -110.49 | 4 | 6 | 2 | 81 | 302.444 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.26 | 1.51 | -38.84 | 3 | 6 | 1 | 79 | 301.436 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.26 | 3.35 | -44.56 | 3 | 6 | 1 | 79 | 301.436 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.