| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 21 | Yes |
Popular Name: N-[(1S)-1-(4-iodophenyl)ethyl]-2-methyl-2-(4-methylpiperazin-1-yl)propan-1-amine N-[(1S)-1-(4-iodophenyl)ethyl]-2…
| 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) | 3.87 | 6.87 | -40.9 | 2 | 3 | 1 | 23 | 402.344 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.87 | 7.7 | -31.25 | 2 | 3 | 1 | 20 | 402.344 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.87 | 9.23 | -97.42 | 3 | 3 | 2 | 24 | 403.352 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
