In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 13 | Yes |
Popular Name: (2S)-N-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]butan-2-amine (2S)-N-[(1S)-2-imidazol-1-yl-1-m…
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) | 1.32 | 6.74 | -40.01 | 2 | 3 | 1 | 34 | 182.291 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.32 | 7.25 | -95.2 | 3 | 3 | 2 | 36 | 183.299 | 5 | ↓ |