In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 16 | Yes |
Popular Name: [(3S)-1-[2-(3-fluorophenyl)ethyl]pyrrolidin-3-yl]methanamine [(3S)-1-[2-(3-fluorophenyl)ethyl…
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) | 1.59 | 6.4 | -109.71 | 4 | 2 | 2 | 32 | 224.323 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 6.02 | -40.19 | 3 | 2 | 1 | 30 | 223.315 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 4.02 | -45.46 | 3 | 2 | 1 | 31 | 223.315 | 4 | ↓ |