In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (3R)-3-amino-4-oxo-4-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]-1,4-diazepan-1-yl]butanamide (3R)-3-amino-4-oxo-4-[4-[[(2R)-t…
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) | -0.71 | 0.67 | -92.92 | 6 | 7 | 2 | 105 | 300.403 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.71 | 0.33 | -40.47 | 5 | 7 | 1 | 103 | 299.395 | 5 | ↓ |