In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 17 | Yes |
Popular Name: 5-chloro-2-[[(1R)-1-[(2S)-tetrahydrofuran-2-yl]ethyl]amino]benzonitrile 5-chloro-2-[[(1R)-1-[(2S)-tetrah…
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) | 3.53 | 5.98 | -6.74 | 1 | 3 | 0 | 45 | 250.729 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.