| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 20 | No |
Popular Name: 4-(chloromethyl)-2-[(1S)-1-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)ethyl]thiazole 4-(chloromethyl)-2-[(1S)-1-(1,3,…
| 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) | 3.69 | 9.75 | -35.71 | 1 | 2 | 1 | 17 | 307.87 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.69 | 7.75 | -5.44 | 0 | 2 | 0 | 16 | 306.862 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
