In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 8th, 2011 | 29 | Yes |
Popular Name: 4-amino-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(4-ethoxyphenyl)pyrimidine-5-carboxamide 4-amino-2-(1,4-dioxa-8-azaspiro[…
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) | 2.16 | 7.35 | -11.35 | 3 | 9 | 0 | 112 | 399.451 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.16 | 7.67 | -40.01 | 4 | 9 | 1 | 113 | 400.459 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.