| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 23 | Yes |
Popular Name: N-[(3-chloro-5-ethoxy-4-methoxy-phenyl)methyl]-1-[(2S)-4-ethylmorpholin-2-yl]methanamine N-[(3-chloro-5-ethoxy-4-methoxy-…
| 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) | 2.56 | 5.38 | -49.92 | 2 | 5 | 1 | 48 | 343.875 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.56 | 3.95 | -7.09 | 1 | 5 | 0 | 43 | 342.867 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.56 | 7.65 | -115.52 | 3 | 5 | 2 | 49 | 344.883 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.56 | 6.23 | -41.4 | 2 | 5 | 1 | 44 | 343.875 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
