| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 18 | Yes |
Popular Name: (7R)-2-(4-methyl-1,4-diazepan-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol (7R)-2-(4-methyl-1,4-diazepan-1-…
| 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) | 1.50 | 5.64 | -39.72 | 2 | 4 | 1 | 41 | 268.406 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.50 | 3.66 | -6.64 | 1 | 4 | 0 | 40 | 267.398 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.50 | 6.05 | -88.63 | 3 | 4 | 2 | 42 | 269.414 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
