In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 18th, 2011 | 20 | Yes |
Popular Name: 2-methoxy-N-[(2S)-2-(4-methylpiperazin-1-yl)-2-(2-thienyl)ethyl]acetamide 2-methoxy-N-[(2S)-2-(4-methylpip…
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) | 0.81 | 4.02 | -45.07 | 2 | 5 | 1 | 46 | 298.432 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.81 | 1.64 | -10.78 | 1 | 5 | 0 | 45 | 297.424 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.