| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 20 | Yes |
Popular Name: 2-[2-chloro-4-[(1R)-1-(methylamino)ethyl]phenyl]sulfanylpyrimidine-4,6-diamine 2-[2-chloro-4-[(1R)-1-(methylami…
| 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) | 2.62 | 4.59 | -50.24 | 6 | 5 | 1 | 94 | 310.834 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.62 | 3.41 | -8.65 | 5 | 5 | 0 | 90 | 309.826 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
