| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 21 | Yes |
Popular Name: N-[[2-(aminomethyl)benzothiophen-3-yl]methyl]-N-(2,2,2-trifluoroethyl)cyclopropanamine N-[[2-(aminomethyl)benzothiophen…
| 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) | 3.35 | 5.74 | -50.04 | 3 | 2 | 1 | 31 | 315.384 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.35 | 6.17 | -5.86 | 2 | 2 | 0 | 29 | 314.376 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.35 | 7.76 | -119.71 | 4 | 2 | 2 | 32 | 316.392 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
