In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2011 | 16 | Yes |
Popular Name: (3S)-3-[(4-chlorophenyl)methyl]pyrrolidine-3-carboxylic (3S)-3-[(4-chlorophenyl)methyl]p…
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) | 2.03 | 6.55 | -45.72 | 2 | 3 | 0 | 57 | 239.702 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.03 | 5.07 | -45.04 | 1 | 3 | -1 | 52 | 238.694 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.