| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 20 | Yes |
Popular Name: 5-(aminomethyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiophene-2-sulfonamide 5-(aminomethyl)-N-(4,5,6,7-tetra…
| 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) | 3.29 | 3.02 | -58.17 | 4 | 5 | 1 | 90 | 330.48 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.37 | 2.08 | -51.25 | 2 | 5 | -1 | 87 | 328.464 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.37 | 2.48 | -84.27 | 3 | 5 | 0 | 89 | 329.472 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
