In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 21 | Yes |
Popular Name: (1S,2R)-1-(8-azaspiro[4.5]decan-8-yl)-1-(5-methyl-2-furyl)butan-2-amine (1S,2R)-1-(8-azaspiro[4.5]decan-…
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) | 3.03 | 8.91 | -114.07 | 4 | 3 | 2 | 45 | 292.467 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.03 | 7.12 | -41.17 | 3 | 3 | 1 | 44 | 291.459 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.03 | 8.6 | -30.31 | 3 | 3 | 1 | 44 | 291.459 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.