In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 27 | Yes |
Popular Name: 2-ethoxy-N-[4-[(2-hydroxyphenyl)methyl-methyl-amino]-4-oxo-butyl]benzamide 2-ethoxy-N-[4-[(2-hydroxyphenyl)…
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) | 3.29 | 7.48 | -16.81 | 2 | 6 | 0 | 79 | 370.449 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.29 | 8.23 | -48.86 | 1 | 6 | -1 | 82 | 369.441 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.