| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 16 | Yes |
Popular Name: 1-(5-chloro-2-thienyl)-N-[[(4S)-1,3-dioxan-4-yl]methyl]-N-methyl-methanamine 1-(5-chloro-2-thienyl)-N-[[(4S)-…
| 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) | 2.52 | 4.18 | -4.77 | 0 | 3 | 0 | 22 | 261.774 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 6.49 | -39.85 | 1 | 3 | 1 | 23 | 262.782 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
