In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: (2S)-2-amino-3-methyl-1-[4-[[(2S)-tetrahydrofuran-2-yl]methyl]-1,4-diazepan-1-yl]butan-1-one (2S)-2-amino-3-methyl-1-[4-[[(2S…
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) | 0.19 | 5.1 | -90.93 | 4 | 5 | 2 | 62 | 285.432 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.19 | 4.77 | -37.45 | 3 | 5 | 1 | 60 | 284.424 | 4 | ↓ |