In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 22nd, 2011 | 23 | Yes |
Popular Name: N-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-1-methyl-imidazole-4-sulfonamide N-(4,5-dihydrobenzo[e][1,3]benzo…
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) | 2.19 | 7.27 | -51.61 | 1 | 6 | 0 | 80 | 346.437 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.11 | 7.57 | -38.61 | 2 | 6 | 1 | 81 | 347.445 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.