In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: (3R)-3-amino-N-[(2R)-2-cyanopropyl]-N-ethyl-3-phenyl-propanamide (3R)-3-amino-N-[(2R)-2-cyanoprop…
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) | -0.04 | 6.56 | -49.1 | 3 | 4 | 1 | 72 | 260.361 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.04 | 6.23 | -9.94 | 2 | 4 | 0 | 70 | 259.353 | 6 | ↓ |