In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: 2-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-1-morpholino-ethanone 2-[4-(2-aminoethyl)-1,4-diazepan…
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) | -1.49 | 0.82 | -97.65 | 4 | 6 | 2 | 65 | 272.393 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.49 | 0.43 | -38.88 | 3 | 6 | 1 | 63 | 271.385 | 4 | ↓ |