| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2011 | 21 | Yes |
Popular Name: 4-amino-4-methyl-1-[4-(2-pyridylmethyl)piperazin-1-yl]pentan-1-one 4-amino-4-methyl-1-[4-(2-pyridyl…
| 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) | 0.55 | 3.33 | -47.63 | 3 | 5 | 1 | 64 | 291.419 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.55 | 3.58 | -91.9 | 4 | 5 | 2 | 65 | 292.427 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.55 | 5.76 | -106.05 | 4 | 5 | 2 | 65 | 292.427 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
