In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 32 | Yes |
Popular Name: (2S)-N-benzhydryl-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]pyrrolidine-2-carboxamide (2S)-N-benzhydryl-1-[(6-chloro-1…
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) | 4.91 | 12.97 | -43.04 | 2 | 5 | 1 | 52 | 449.958 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.10 | 10.93 | -32.96 | 1 | 5 | 0 | 58 | 448.95 | 6 | ↓ |