In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2011 | 27 | Yes |
Popular Name: 1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-[propyl-[(2R)-tetralin-2-yl]amino]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) | 3.15 | 10.33 | -42.55 | 1 | 5 | 1 | 43 | 373.517 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.15 | 8.48 | -9.19 | 0 | 5 | 0 | 42 | 372.509 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.