| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 17 | Yes |
Popular Name: (2S,4R,5R)-1,2,5-trimethyl-N-[(1S)-1-(3-thienyl)ethyl]piperidin-4-amine (2S,4R,5R)-1,2,5-trimethyl-N-[(1…
| 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 | 7.34 | -34.14 | 2 | 2 | 1 | 16 | 253.435 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.87 | 5.81 | -36.25 | 2 | 2 | 1 | 20 | 253.435 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.87 | 8.12 | -98.87 | 3 | 2 | 2 | 21 | 254.443 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
