In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2010 | 15 | Yes |
Popular Name: (3S)-1-[(2,5-difluorophenyl)methyl]pyrrolidin-3-amine (3S)-1-[(2,5-difluorophenyl)meth…
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) | 0.99 | 4.49 | -33.38 | 3 | 2 | 1 | 30 | 213.251 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.99 | 2.26 | -44.87 | 3 | 2 | 1 | 31 | 213.251 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.99 | 4.78 | -115.58 | 4 | 2 | 2 | 32 | 214.259 | 2 | ↓ |