In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 15 | Yes |
Popular Name: (2S)-2-methyl-3-[[(1R,2R)-2-phenylcyclopropyl]amino]propanenitrile (2S)-2-methyl-3-[[(1R,2R)-2-phen…
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) | 2.33 | 7.95 | -47.16 | 2 | 2 | 1 | 40 | 201.293 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.33 | 6.76 | -5.14 | 1 | 2 | 0 | 36 | 200.285 | 4 | ↓ |