In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 23 | No |
Popular Name: N-[4-[(4-methylthiazol-2-yl)amino]phenyl]-2-thioxo-1H-pyridine-3-carboxamide N-[4-[(4-methylthiazol-2-yl)amin…
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) | 2.81 | 6.78 | -37.56 | 3 | 5 | 0 | 70 | 342.449 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.54 | 6.41 | -62.99 | 2 | 5 | -1 | 67 | 341.441 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.