In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 24 | Yes |
Popular Name: 2-(3-fluorophenyl)-N-[(2S)-2-phenyl-2-pyrrolidin-1-yl-ethyl]acetamide 2-(3-fluorophenyl)-N-[(2S)-2-phe…
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) | 3.38 | 10.45 | -42.72 | 2 | 3 | 1 | 34 | 327.423 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 7.73 | -9.3 | 1 | 3 | 0 | 32 | 326.415 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.