In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 24 | Yes |
Popular Name: 1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-(quinazolin-4-ylamino)ethanone 1-(1,4-dioxa-8-azaspiro[4.5]deca…
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) | 1.15 | 6.01 | -10.9 | 1 | 7 | 0 | 77 | 328.372 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.15 | 6.47 | -34.35 | 2 | 7 | 1 | 78 | 329.38 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.