In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 18th, 2011 | 20 | Yes |
Popular Name: (2S)-3-(3-azaspiro[5.5]undecan-3-yl)-2-cyclopropyl-2-(methylamino)propanenitrile (2S)-3-(3-azaspiro[5.5]undecan-3…
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) | 3.23 | 8.89 | -39.38 | 2 | 3 | 1 | 40 | 276.448 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.23 | 6.18 | -3.16 | 1 | 3 | 0 | 39 | 275.44 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.