In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 26th, 2011 | 19 | Yes |
Popular Name: (2R)-N-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxamide (2R)-N-[[4-(trifluoromethyl)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) | 1.89 | 4.9 | -39.5 | 3 | 3 | 1 | 46 | 273.278 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.89 | 3.5 | -6.98 | 2 | 3 | 0 | 41 | 272.27 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.