In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 20 | Yes |
Popular Name: N-[(6R)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]pyridine-3-sulfonamide N-[(6R)-6-methyl-4,5,6,7-tetrahy…
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) | 3.33 | 4.64 | -12.05 | 1 | 5 | 0 | 75 | 309.416 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 4.1 | -48.75 | 0 | 5 | -1 | 74 | 308.408 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.33 | 5.1 | -38.8 | 2 | 5 | 1 | 76 | 310.424 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.