| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | Yes |
Popular Name: 2-[5-[[methyl(3-thienylmethyl)amino]methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine 2-[5-[[methyl(3-thienylmethyl)am…
| 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) | 1.02 | 3.11 | -106.48 | 4 | 5 | 2 | 71 | 268.386 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.02 | 0.45 | -6.47 | 2 | 5 | 0 | 68 | 266.37 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.02 | 0.73 | -43.89 | 3 | 5 | 1 | 70 | 267.378 | 5 | ↓ |
