In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]butanamide (2S)-2-amino-N-methyl-N-[2-(2-me…
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) | 1.49 | 4.82 | -41.07 | 3 | 4 | 1 | 57 | 251.35 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.49 | 4.53 | -6.63 | 2 | 4 | 0 | 56 | 250.342 | 6 | ↓ |