In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 20 | Yes |
Popular Name: 2-[2-(aminomethyl)phenoxy]-1-(4-methyl-1,4-diazepan-1-yl)ethanone 2-[2-(aminomethyl)phenoxy]-1-(4-…
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) | 0.64 | 6.62 | -94.65 | 4 | 5 | 2 | 62 | 279.384 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.64 | 4.09 | -41.02 | 3 | 5 | 1 | 60 | 278.376 | 4 | ↓ |