In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 15 | Yes |
Popular Name: (2R)-3-[ethyl-[[(2R)-tetrahydropyran-2-yl]methyl]amino]-2-methyl-propanenitrile (2R)-3-[ethyl-[[(2R)-tetrahydrop…
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) | 2.13 | 7.42 | -42.77 | 1 | 3 | 1 | 37 | 211.329 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.13 | 5.32 | -4.82 | 0 | 3 | 0 | 36 | 210.321 | 5 | ↓ |