| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | No |
Popular Name: (4S)-N-[(1S,2S)-2-imidazol-1-ylcyclopentyl]isothiochroman-4-amine (4S)-N-[(1S,2S)-2-imidazol-1-ylc…
| 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) | 2.55 | 11.13 | -108.81 | 3 | 3 | 2 | 36 | 301.459 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.55 | 9.83 | -7.42 | 1 | 3 | 0 | 30 | 299.443 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | 10.39 | -49.37 | 2 | 3 | 1 | 34 | 300.451 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
