| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 22 | Yes |
Popular Name: (2S)-N-[3-(diethylaminomethyl)phenyl]-2-imidazol-1-yl-propanamide (2S)-N-[3-(diethylaminomethyl)ph…
| 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) | 1.69 | 10.4 | -81.28 | 3 | 5 | 2 | 53 | 302.422 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.69 | 7.48 | -13.91 | 1 | 5 | 0 | 50 | 300.406 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | 9.57 | -48.86 | 2 | 5 | 1 | 51 | 301.414 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
