In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 16 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(methylamino)-3-tetrahydropyran-4-yloxy-propanenitrile (2S)-2-cyclopropyl-2-(methylamin…
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) | 1.17 | 2.24 | -9.59 | 1 | 4 | 0 | 54 | 224.304 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.17 | 3.55 | -50.31 | 2 | 4 | 1 | 59 | 225.312 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.