| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2011 | 19 | Yes |
Popular Name: (7S)-7-tert-butyl-3-piperazin-1-yl-4,5,6,7-tetrahydro-2H-indazole (7S)-7-tert-butyl-3-piperazin-1-…
| 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) | 2.51 | 6.4 | -42.05 | 3 | 4 | 1 | 49 | 263.409 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.51 | 5.09 | -6.05 | 2 | 4 | 0 | 44 | 262.401 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.51 | 6.62 | -87.5 | 4 | 4 | 2 | 50 | 264.417 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
