In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | Yes |
Popular Name: (2S,3R)-2-amino-N-[4-(cyanomethyl)phenyl]-3-methyl-pentanamide (2S,3R)-2-amino-N-[4-(cyanomethy…
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) | 1.57 | 4.73 | -51.28 | 4 | 4 | 1 | 81 | 246.334 | 5 | ↓ |