In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: 1-[(2R)-2,4-diamino-4-oxo-butanoyl]-N-ethyl-piperidine-4-carboxamide 1-[(2R)-2,4-diamino-4-oxo-butano…
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) | -0.99 | -2.43 | -43.37 | 6 | 7 | 1 | 120 | 271.341 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.99 | -2.77 | -15.21 | 5 | 7 | 0 | 119 | 270.333 | 5 | ↓ |