In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: (3R)-3-[(4-chloro-3-fluoro-phenyl)methylamino]-3-(2-thienyl)propanoic (3R)-3-[(4-chloro-3-fluoro-pheny…
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) | 3.26 | 8.94 | -50.62 | 2 | 3 | 0 | 57 | 313.781 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.26 | 7.77 | -43.22 | 1 | 3 | -1 | 52 | 312.773 | 6 | ↓ |