In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2008 | 21 | Yes |
Popular Name: 1-ethyl-N-[(6R)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]pyrazole-4-sulfonamide 1-ethyl-N-[(6R)-6-methyl-4,5,6,7…
None
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) | 3.15 | 5 | -13.45 | 1 | 6 | 0 | 80 | 326.447 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 4.47 | -49.3 | 0 | 6 | -1 | 79 | 325.439 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.