In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2004 | 28 | No |
Popular Name: (E)-1,3-benzodioxol-5-yl-[(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methylene]amine (E)-1,3-benzodioxol-5-yl-[(3-met…
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) | 3.86 | 11.52 | -10.42 | 0 | 6 | 0 | 52 | 374.444 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.86 | 10.58 | -39.64 | 1 | 6 | 1 | 54 | 375.452 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.86 | 12.45 | -35.51 | 1 | 6 | 1 | 54 | 375.452 | 4 | ↓ |