In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2S)-2-amino-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-butanediamide (2S)-2-amino-N-(2,3-dihydro-1,4-…
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) | -0.34 | -0.31 | -42.02 | 5 | 7 | 1 | 110 | 294.331 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.34 | -0.64 | -15.75 | 4 | 7 | 0 | 108 | 293.323 | 5 | ↓ |