| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 19 | Yes |
Popular Name: (4R)-N-[[(3S)-1-isopropylpyrrolidin-3-yl]methyl]-4,5,6,7-tetrahydrobenzothiophen-4-amine (4R)-N-[[(3S)-1-isopropylpyrroli…
| 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) | 2.39 | 9.53 | -105.37 | 3 | 2 | 2 | 21 | 280.481 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 8.39 | -32.65 | 2 | 2 | 1 | 16 | 279.473 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 7.11 | -41.44 | 2 | 2 | 1 | 20 | 279.473 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
