In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 20 | Yes |
Popular Name: [4-[(1S)-3-amino-1-ethyl-propyl]-1,4-diazepan-1-yl]-[(2S)-tetrahydrofuran-2-yl]methanone [4-[(1S)-3-amino-1-ethyl-propyl]…
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) | 0.14 | 5.54 | -122.6 | 4 | 5 | 2 | 62 | 285.432 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.14 | 4.3 | -53.44 | 3 | 5 | 1 | 60 | 284.424 | 5 | ↓ |