| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 18 | Yes |
Popular Name: N-[[4-[(4-methylpiperazin-1-yl)methyl]thiazol-2-yl]methyl]propan-1-amine N-[[4-[(4-methylpiperazin-1-yl)m…
| 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) | 0.97 | 4.46 | -84.01 | 3 | 4 | 2 | 37 | 270.446 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 0.74 | -5.28 | 1 | 4 | 0 | 31 | 268.43 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.97 | 2.1 | -38.4 | 2 | 4 | 1 | 36 | 269.438 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.97 | 4.35 | -89.88 | 3 | 4 | 2 | 37 | 270.446 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
