In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(3,4-dimethylphenyl)methanamine N-(1,3-benzodioxol-5-ylmethyl)-1…
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) | 3.61 | 8.13 | -49.81 | 2 | 3 | 1 | 35 | 270.352 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.61 | 6.78 | -6.73 | 1 | 3 | 0 | 30 | 269.344 | 4 | ↓ |