In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: (2S)-2-amino-N-methyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]butanediamide (2S)-2-amino-N-methyl-N-[[(2R)-t…
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) | -0.87 | -2.06 | -36.58 | 5 | 6 | 1 | 100 | 230.288 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.87 | -2.39 | -10.25 | 4 | 6 | 0 | 99 | 229.28 | 5 | ↓ |