In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | Yes |
Popular Name: (2S)-1-[(2S)-2,4-diamino-4-oxo-butanoyl]-N-methyl-pyrrolidine-2-carboxamide (2S)-1-[(2S)-2,4-diamino-4-oxo-b…
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) | -1.75 | -2.98 | -40.79 | 6 | 7 | 1 | 120 | 243.287 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.75 | -3.33 | -17.95 | 5 | 7 | 0 | 119 | 242.279 | 4 | ↓ |