| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2011 | 16 | Yes |
Popular Name: (2S)-1-[1-(3-pyridylmethyl)imidazol-2-yl]propan-2-amine (2S)-1-[1-(3-pyridylmethyl)imida…
| 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) | -0.16 | 4.23 | -44.71 | 3 | 4 | 1 | 58 | 217.296 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.16 | 3.88 | -8.76 | 2 | 4 | 0 | 57 | 216.288 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.16 | 4.76 | -112.34 | 4 | 4 | 2 | 60 | 218.304 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
