| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2011 | 17 | Yes |
Popular Name: N-(2-pyridylmethyl)-N-(2-thienylmethyl)prop-2-en-1-amine N-(2-pyridylmethyl)-N-(2-thienyl…
| 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 | 6.02 | -5.3 | 0 | 2 | 0 | 16 | 244.363 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.51 | 7 | -30.49 | 1 | 2 | 1 | 17 | 245.371 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.51 | 8.13 | -31.64 | 1 | 2 | 1 | 17 | 245.371 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
