In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: (1S,2S)-2-[[4-(cyanomethyl)phenyl]carbamoyl]cyclopropanecarboxylic (1S,2S)-2-[[4-(cyanomethyl)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) | 1.43 | 6.77 | -54.29 | 1 | 5 | -1 | 93 | 243.242 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.43 | 4.78 | -15.43 | 2 | 5 | 0 | 90 | 244.25 | 4 | ↓ |