In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2009 | 17 | Yes |
Popular Name: (2S)-2-(m-tolyl)-2-[[(2R)-tetrahydrofuran-2-yl]methylamino]acetonitrile (2S)-2-(m-tolyl)-2-[[(2R)-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) | 2.26 | 5.48 | -6.88 | 1 | 3 | 0 | 45 | 230.311 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.26 | 6.56 | -45.18 | 2 | 3 | 1 | 50 | 231.319 | 4 | ↓ |