| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 18 | No |
Popular Name: (2R,3R)-3-phenyl-2-(1,4-thiazepan-4-yl)butan-1-amine (2R,3R)-3-phenyl-2-(1,4-thiazepa…
| 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 | 5.38 | -47.36 | 3 | 2 | 1 | 31 | 265.446 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.39 | 7.14 | -129.08 | 4 | 2 | 2 | 32 | 266.454 | 4 | ↓ |
