| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 17 | Yes |
Popular Name: (2S)-N-(1,3-benzothiazol-2-ylmethyl)-1-cyclopropyl-propan-2-amine (2S)-N-(1,3-benzothiazol-2-ylmet…
| 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) | 3.13 | 7.62 | -38.37 | 2 | 2 | 1 | 29 | 247.387 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 6.42 | -6.57 | 1 | 2 | 0 | 25 | 246.379 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
