| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 18 | Yes |
Popular Name: (7S)-2-(azocan-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-amine (7S)-2-(azocan-1-yl)-4,5,6,7-tet…
| 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) | 1.56 | 6.59 | -43.29 | 3 | 3 | 1 | 44 | 266.434 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.56 | 6.27 | -5.13 | 2 | 3 | 0 | 42 | 265.426 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.56 | 6.9 | -92.29 | 4 | 3 | 2 | 45 | 267.442 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
