In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 23 | Yes |
Popular Name: (2R)-N-(1,3-benzothiazol-2-yl)-2-[(6-methyl-5-oxo-4H-1,2,4-triazin-3-yl)sulfanyl]propanamide (2R)-N-(1,3-benzothiazol-2-yl)-2…
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) | 2.01 | 4.89 | -17.06 | 2 | 7 | 0 | 101 | 347.425 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 1.87 | -48.72 | 1 | 7 | -1 | 107 | 346.417 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.