In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 20 | Yes |
Popular Name: 3-[(1R)-1-(ethylamino)ethyl]-N-thiazol-2-yl-benzenesulfonamide 3-[(1R)-1-(ethylamino)ethyl]-N-t…
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) | 2.23 | 4.02 | -69.9 | 2 | 5 | 0 | 78 | 311.432 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 4.23 | -47.02 | 3 | 5 | 1 | 76 | 312.44 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.