| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 16 | Yes |
Popular Name: (1S)-N-[(5-chloro-2-thienyl)methyl]-1-(4-pyridyl)ethanamine (1S)-N-[(5-chloro-2-thienyl)meth…
| 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) | 2.87 | 6.98 | -49.95 | 2 | 2 | 1 | 29 | 253.778 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.87 | 5.69 | -4.29 | 1 | 2 | 0 | 25 | 252.77 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.87 | 6.19 | -33.81 | 2 | 2 | 1 | 26 | 253.778 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
