In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 15 | Yes |
Popular Name: 4-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]pyridin-3-amine 4-[[(4R)-1,3-dioxan-4-yl]methyls…
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) | 0.79 | 2.18 | -7.21 | 2 | 4 | 0 | 57 | 226.301 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.79 | 2.64 | -33.75 | 3 | 4 | 1 | 59 | 227.309 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.