In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 2-[4-[2-[(2-aminoacetyl)amino]acetyl]-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide 2-[4-[2-[(2-aminoacetyl)amino]ac…
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) | -2.85 | 0.9 | -97.28 | 5 | 8 | 2 | 102 | 301.391 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.85 | -1.23 | -15.23 | 3 | 8 | 0 | 99 | 299.375 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.85 | 0.55 | -46.32 | 4 | 8 | 1 | 100 | 300.383 | 5 | ↓ |