In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2010 | 21 | Yes |
Popular Name: N-ethyl-4-[[(1R)-1-methyl-2-morpholino-ethyl]amino]pyridine-2-carboxamide N-ethyl-4-[[(1R)-1-methyl-2-morp…
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) | 1.41 | 0.94 | -9 | 2 | 6 | 0 | 66 | 292.383 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 3.27 | -45.72 | 3 | 6 | 1 | 68 | 293.391 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 1.41 | -36.73 | 3 | 6 | 1 | 68 | 293.391 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.41 | 3.74 | -97.9 | 4 | 6 | 2 | 69 | 294.399 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.