| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 32 | Yes |
Popular Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-methyl-oxo-BLAHcarboxamide N-[4-(4-ethylpiperazin-1-yl)-2-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) | 3.48 | 11.43 | -49.73 | 2 | 7 | 1 | 72 | 452.604 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.48 | 9.2 | -17.44 | 1 | 7 | 0 | 70 | 451.596 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
