In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 19 | No |
Popular Name: 2-methyl-N-[[4-[(1-oxo-1,4-thiazinan-4-yl)methyl]thiazol-2-yl]methyl]propan-1-amine 2-methyl-N-[[4-[(1-oxo-1,4-thiaz…
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) | 0.18 | 2.59 | -47.45 | 2 | 4 | 1 | 50 | 302.489 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.18 | 1.21 | -17.31 | 1 | 4 | 0 | 45 | 301.481 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.18 | 4.72 | -108.07 | 3 | 4 | 2 | 51 | 303.497 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.