| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 21 | Yes |
Popular Name: 1-(3-methylbut-2-enyl)-N-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]piperidin-4-amine 1-(3-methylbut-2-enyl)-N-[(4S)-4…
| 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) | 3.28 | 9.7 | -36.2 | 2 | 2 | 1 | 16 | 305.511 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.28 | 7.96 | -39.07 | 2 | 2 | 1 | 20 | 305.511 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.28 | 10.24 | -103.55 | 3 | 2 | 2 | 21 | 306.519 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
