In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 20 | Yes |
Popular Name: N-(1,3-benzodioxol-4-ylmethyl)-1-(1,3,5-trimethylpyrazol-4-yl)methanamine N-(1,3-benzodioxol-4-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) | 1.58 | 5.62 | -46.48 | 2 | 5 | 1 | 53 | 274.344 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.58 | 4.25 | -10.77 | 1 | 5 | 0 | 48 | 273.336 | 4 | ↓ |