In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2009 | 33 | Yes |
Popular Name: N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-4-phenyl-N-[2-(1-piperidyl)ethyl]benzamide N-[2-[(5-methylisoxazol-3-yl)ami…
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) | 3.64 | 13.56 | -64.18 | 2 | 7 | 1 | 80 | 447.559 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.64 | 11.28 | -16.34 | 1 | 7 | 0 | 79 | 446.551 | 8 | ↓ |