In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 15 | Yes |
Popular Name: (2S)-2-amino-N-methyl-N-[(2-methylthiazol-5-yl)methyl]butanamide (2S)-2-amino-N-methyl-N-[(2-meth…
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) | -0.31 | 2.42 | -43.78 | 3 | 4 | 1 | 61 | 228.341 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.31 | 2.13 | -8.62 | 2 | 4 | 0 | 59 | 227.333 | 4 | ↓ |