In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 1-[(2R)-2,4-diamino-4-oxo-butanoyl]-N-(3-hydroxypropyl)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) | -1.73 | -5.02 | -49.05 | 7 | 8 | 1 | 140 | 301.367 | 7 | ↓ |
Hi High (pH 8-9.5) | -1.73 | -5.34 | -20.84 | 6 | 8 | 0 | 139 | 300.359 | 7 | ↓ |