| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 27th, 2010 | 24 | Yes |
Popular Name: (2S)-2-(3-fluorophenyl)-5-(2H-imidazol-2-ylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine (2S)-2-(3-fluorophenyl)-5-(2H-im…
| 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) | 3.85 | 9.02 | -7.02 | 0 | 3 | 0 | 28 | 339.439 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.85 | 9.88 | -44.22 | 1 | 3 | 1 | 30 | 340.447 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.85 | 9.97 | -47.06 | 1 | 3 | 1 | 30 | 340.447 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
