| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 4th, 2010 | 20 | Yes |
Popular Name: 1-[4-[5-(3-aminoprop-1-ynyl)thiophene-2-carbonyl]piperazin-1-yl]ethanone 1-[4-[5-(3-aminoprop-1-ynyl)thio…
| 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) | -0.23 | 3.97 | -59.04 | 3 | 5 | 1 | 68 | 292.384 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.23 | 3.56 | -12.76 | 2 | 5 | 0 | 67 | 291.376 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
