In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 18th, 2011 | 21 | Yes |
Popular Name: (2S)-3-(8-azaspiro[4.5]decan-8-yl)-2-cyclopropyl-2-(cyclopropylamino)propanenitrile (2S)-3-(8-azaspiro[4.5]decan-8-y…
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) | 3.09 | 8.86 | -39.12 | 2 | 3 | 1 | 40 | 288.459 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.09 | 6.95 | -3.41 | 1 | 3 | 0 | 39 | 287.451 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.