| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2011 | 23 | Yes |
Popular Name: (1R)-N-(1,3-benzothiazol-2-ylmethyl)-1-(5-isobutyl-1,3,4-oxadiazol-2-yl)-N-methyl-ethanamine (1R)-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) | 2.22 | 3.44 | -12.31 | 0 | 5 | 0 | 55 | 330.457 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.22 | 5.25 | -42.11 | 1 | 5 | 1 | 56 | 331.465 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
