In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 28 | Yes |
Popular Name: N-[(2S)-2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]-6-methyl-pyridine-3-carboxamide N-[(2S)-2-(3,4-dimethoxyphenyl)-…
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) | 1.05 | 3.8 | -13.34 | 1 | 7 | 0 | 73 | 385.464 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.05 | 6.1 | -56.76 | 2 | 7 | 1 | 74 | 386.472 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.