In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: (2S)-2-amino-N-[3-fluoro-4-[isopropyl(methyl)amino]phenyl]butanamide (2S)-2-amino-N-[3-fluoro-4-[isop…
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) | 1.73 | 4.64 | -47.76 | 4 | 4 | 1 | 60 | 268.356 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.73 | 4.35 | -9.4 | 3 | 4 | 0 | 58 | 267.348 | 5 | ↓ |