| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 20 | Yes |
Popular Name: N-[[4-[(4-isopropylpiperazin-1-yl)methyl]thiazol-2-yl]methyl]propan-1-amine N-[[4-[(4-isopropylpiperazin-1-y…
| 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) | 1.64 | 5.65 | -82.16 | 3 | 4 | 2 | 37 | 298.5 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 3.45 | -38.08 | 2 | 4 | 1 | 36 | 297.492 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 5.7 | -90.6 | 3 | 4 | 2 | 37 | 298.5 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
