| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2010 | 21 | Yes |
Popular Name: (2S)-1-tert-butoxy-3-[4-(2-thienylmethyl)piperazin-1-yl]propan-2-ol (2S)-1-tert-butoxy-3-[4-(2-thien…
None
| 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) | 2.06 | 2.34 | -5.86 | 1 | 4 | 0 | 36 | 312.479 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | 4.59 | -38.4 | 2 | 4 | 1 | 37 | 313.487 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | 4.6 | -36.5 | 2 | 4 | 1 | 37 | 313.487 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
