| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 20 | Yes |
Popular Name: 5-(aminomethyl)-N-(1,3-benzodioxol-5-yl)thiophene-2-sulfonamide 5-(aminomethyl)-N-(1,3-benzodiox…
| 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) | 1.97 | 0.29 | -76.7 | 3 | 6 | 0 | 94 | 312.372 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.97 | -0.1 | -43.37 | 2 | 6 | -1 | 93 | 311.364 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 0.28 | -56.93 | 4 | 6 | 1 | 92 | 313.38 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
