In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2008 | 26 | Yes |
Popular Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-1-[4-(morpholinomethyl)phenyl]methanamine N-[(7-bromo-1,3-benzodioxol-5-yl…
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) | 3.17 | 6.62 | -56.13 | 2 | 5 | 1 | 48 | 420.327 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.17 | 5.21 | -7.76 | 1 | 5 | 0 | 43 | 419.319 | 6 | ↓ |