In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 25 | Yes |
Popular Name: N-[4-[2-(2-dimethylaminoethyloxy)phenyl]thiazol-2-yl]butane-1-sulfonamide N-[4-[2-(2-dimethylaminoethyloxy…
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) | 4.30 | 7.74 | -44.64 | 2 | 6 | 1 | 76 | 384.547 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.37 | 5.43 | -51.09 | 0 | 6 | -1 | 74 | 382.531 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.37 | 7.9 | -50.41 | 1 | 6 | 0 | 75 | 383.539 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.