| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 19 | Yes |
Popular Name: (1R)-1-(1,3-benzothiazol-2-yl)-N-(2-pyrrolidin-1-ylethyl)ethanamine (1R)-1-(1,3-benzothiazol-2-yl)-N…
| 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) | 2.65 | 6.49 | -40.43 | 2 | 3 | 1 | 29 | 276.429 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.65 | 3.96 | -7.52 | 1 | 3 | 0 | 28 | 275.421 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.65 | 7.76 | -120.07 | 3 | 3 | 2 | 34 | 277.437 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
