In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | Yes |
Popular Name: (2R,3S)-2-amino-N-[6-(dimethylamino)-3-pyridyl]-3-methyl-pentanamide (2R,3S)-2-amino-N-[6-(dimethylam…
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) | 0.98 | 3.42 | -47.33 | 4 | 5 | 1 | 73 | 251.354 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 3.13 | -7.81 | 3 | 5 | 0 | 71 | 250.346 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.98 | 3.79 | -90.29 | 5 | 5 | 2 | 74 | 252.362 | 5 | ↓ |