In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 22 | Yes |
Popular Name: N-[(2-fluorophenyl)methyl]-N-methyl-2-[methyl-[(5-methylisoxazol-3-yl)methyl]amino]acetamide N-[(2-fluorophenyl)methyl]-N-met…
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) | 1.55 | 8.48 | -43.82 | 1 | 5 | 1 | 51 | 306.361 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.55 | 6.22 | -12.9 | 0 | 5 | 0 | 50 | 305.353 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.