In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 16 | Yes |
Popular Name: 1-(3-bromo-4-methyl-phenyl)-3,5-dimethyl-pyrazol-4-amine 1-(3-bromo-4-methyl-phenyl)-3,5-…
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) | 2.91 | 5.86 | -9.42 | 2 | 3 | 0 | 44 | 280.169 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.91 | 5.69 | -51.14 | 3 | 3 | 1 | 45 | 281.177 | 1 | ↓ |