| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 36 | Yes |
Popular Name: N-cycloheptyl-methyl-oxo-[3-(4-propylpiperazin-1-yl)propyl]BLAHcarboxamide N-cycloheptyl-methyl-oxo-[3-(4-p…
| 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) | 3.91 | 11.34 | -47.13 | 2 | 8 | 1 | 75 | 498.692 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.91 | 8.96 | -12.28 | 1 | 8 | 0 | 74 | 497.684 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.91 | 11.18 | -51.19 | 2 | 8 | 1 | 75 | 498.692 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
