| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2010 | 17 | Yes |
Popular Name: (2R)-N-prop-2-ynyl-2-[2-(2-thienyl)imidazol-1-yl]propan-1-amine (2R)-N-prop-2-ynyl-2-[2-(2-thien…
| 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) | 1.85 | 6.18 | -8.81 | 1 | 3 | 0 | 30 | 245.351 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 8.17 | -96.06 | 3 | 3 | 2 | 36 | 247.367 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 7.57 | -51.19 | 2 | 3 | 1 | 34 | 246.359 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 6.78 | -28.81 | 2 | 3 | 1 | 31 | 246.359 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
