In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2011 | 27 | Yes |
Popular Name: 3-bromo-N-[2-[[(2R)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]amino]-2-oxo-ethyl]benzamide 3-bromo-N-[2-[[(2R)-2-(dimethyla…
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) | 3.19 | 6.9 | -49.5 | 3 | 6 | 1 | 72 | 435.342 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.19 | 5.24 | -11.82 | 2 | 6 | 0 | 71 | 434.334 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.