In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 14 | Yes |
Popular Name: (2S)-2-amino-N-methyl-N-[(1S)-1-(2-thienyl)ethyl]propanamide (2S)-2-amino-N-methyl-N-[(1S)-1-…
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) | 0.73 | 3.01 | -43.66 | 3 | 3 | 1 | 48 | 213.326 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.73 | 2.71 | -8.49 | 2 | 3 | 0 | 46 | 212.318 | 3 | ↓ |