In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 16 | Yes |
Popular Name: (2R)-2-amino-N-[(1S)-1-(2-bromophenyl)ethyl]butanamide (2R)-2-amino-N-[(1S)-1-(2-bromop…
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) | 1.88 | 3.81 | -44.13 | 4 | 3 | 1 | 57 | 286.193 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.88 | 3.51 | -7.6 | 3 | 3 | 0 | 55 | 285.185 | 4 | ↓ |