In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 23 | Yes |
Popular Name: N-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1-(3,4-dimethoxyphenyl)methanamine N-[(7-chloro-1,3-benzodioxol-5-y…
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) | 3.04 | 6.64 | -61.42 | 2 | 5 | 1 | 54 | 336.795 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.04 | 5.22 | -10.98 | 1 | 5 | 0 | 49 | 335.787 | 6 | ↓ |