| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 21 | Yes |
Popular Name: (1S)-1-[3-chloro-4-(4-isobutylpiperazin-1-yl)phenyl]-N-methyl-ethanamine (1S)-1-[3-chloro-4-(4-isobutylpi…
| 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) | 3.78 | 10.52 | -85 | 3 | 3 | 2 | 24 | 311.901 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.78 | 8.6 | -41.02 | 2 | 3 | 1 | 23 | 310.893 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
