In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 16 | No |
Popular Name: N-methyl-1-[4-[(1-oxo-1,4-thiazinan-4-yl)methyl]thiazol-2-yl]methanamine N-methyl-1-[4-[(1-oxo-1,4-thiazi…
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) | -0.94 | 0.28 | -47.67 | 2 | 4 | 1 | 50 | 260.408 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.94 | -1.17 | -17.71 | 1 | 4 | 0 | 45 | 259.4 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.94 | 2.41 | -106.47 | 3 | 4 | 2 | 51 | 261.416 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.