In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2010 | 21 | Yes |
Popular Name: 5-[(isobutylamino)methyl]-N-methyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]pyridin-2-amine 5-[(isobutylamino)methyl]-N-meth…
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) | 2.70 | 8.7 | -39.78 | 2 | 4 | 1 | 42 | 292.447 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.70 | 9.2 | -96.02 | 3 | 4 | 2 | 43 | 293.455 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.