In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 30 | No |
Popular Name: N-(1-benzyl-4-piperidyl)-2-(3-oxo-5-phenyl-1,4-thiazin-4-yl)acetamide N-(1-benzyl-4-piperidyl)-2-(3-ox…
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) | 2.98 | 11.92 | -44.95 | 2 | 5 | 1 | 54 | 422.574 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.98 | 9.69 | -12.4 | 1 | 5 | 0 | 53 | 421.566 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.