| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | Yes |
Popular Name: (4R)-6-chloro-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]thiochroman-4-amine (4R)-6-chloro-N-[[(2S)-1-ethylpy…
| 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) | 2.75 | 8.73 | -39.51 | 2 | 2 | 1 | 20 | 311.902 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.75 | 9.25 | -34.61 | 2 | 2 | 1 | 16 | 311.902 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.75 | 10.5 | -122.62 | 3 | 2 | 2 | 21 | 312.91 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
