| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 21 | No |
Popular Name: 4-isopentyl-N-[(1R,2R,4S)-norbornan-2-yl]piperazine-1-carbothioamide 4-isopentyl-N-[(1R,2R,4S)-norbor…
| 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) | 3.61 | 11.19 | -51.09 | 2 | 3 | 1 | 20 | 310.531 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.61 | 8.97 | -9.63 | 1 | 3 | 0 | 19 | 309.523 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
