| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 21 | Yes |
Popular Name: (2S)-N-[2-(4-thiazol-2-ylpiperazin-1-yl)ethyl]heptan-2-amine (2S)-N-[2-(4-thiazol-2-ylpiperaz…
| 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) | 3.55 | 7.4 | -43.25 | 2 | 4 | 1 | 36 | 311.519 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.55 | 7.83 | -79.67 | 3 | 4 | 2 | 37 | 312.527 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
