| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 21 | Yes |
Popular Name: 3-(3-aminophenyl)-1-[4-[(1S)-1-methylpropyl]piperazin-1-yl]propan-1-one 3-(3-aminophenyl)-1-[4-[(1S)-1-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) | 2.14 | 7.71 | -41.02 | 3 | 4 | 1 | 51 | 290.431 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.14 | 5.87 | -7.3 | 2 | 4 | 0 | 50 | 289.423 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
