| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 26 | Yes |
Popular Name: (E)-N-[(1S)-3-methyl-1-(4-methylpiperazine-1-carbonyl)butyl]-3-phenyl-but-2-enamide (E)-N-[(1S)-3-methyl-1-(4-methyl…
| 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) | 2.53 | 7.48 | -6.72 | 1 | 5 | 0 | 53 | 357.498 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.53 | 9.86 | -45.81 | 2 | 5 | 1 | 54 | 358.506 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
