In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 19 | Yes |
Popular Name: N-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1-phenyl-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) | 3.39 | 7.42 | -52.46 | 2 | 3 | 1 | 35 | 276.743 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.39 | 6.07 | -6.23 | 1 | 3 | 0 | 30 | 275.735 | 4 | ↓ |