| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 19 | No |
Popular Name: N-[(2S)-2-phenyl-2-(1,4-thiazepan-4-yl)ethyl]propan-2-amine N-[(2S)-2-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) | 3.04 | 10.36 | -115.74 | 3 | 2 | 2 | 21 | 280.481 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.04 | 8.55 | -40.87 | 2 | 2 | 1 | 20 | 279.473 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
