In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 18 | Yes |
Popular Name: (5-isopropoxy-3-methyl-1-phenyl-pyrazol-4-yl)methanamine (5-isopropoxy-3-methyl-1-phenyl-…
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) | 1.92 | 4.77 | -48.21 | 3 | 4 | 1 | 55 | 246.334 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.92 | 4.92 | -7.42 | 2 | 4 | 0 | 53 | 245.326 | 4 | ↓ |