| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2009 | 16 | No |
Popular Name: N-[(1R)-1-(2,5-dimethyl-3-thienyl)ethyl]tetrahydrothiopyran-4-amine N-[(1R)-1-(2,5-dimethyl-3-thieny…
| 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) | 3.00 | 8.49 | -41.21 | 2 | 1 | 1 | 17 | 256.46 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.00 | 7.7 | -3.39 | 1 | 1 | 0 | 12 | 255.452 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
