In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: 1-[(2R)-2-amino-3-methyl-butanoyl]-N-ethyl-piperidine-4-carboxamide 1-[(2R)-2-amino-3-methyl-butanoy…
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) | -0.10 | 1.86 | -48.57 | 4 | 5 | 1 | 77 | 256.37 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.10 | 1.72 | -10.95 | 3 | 5 | 0 | 75 | 255.362 | 4 | ↓ |