In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 19 | Yes |
Popular Name: 2-(4-bromophenyl)-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]propan-2-amine 2-(4-bromophenyl)-N-[(3,5-dimeth…
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) | 3.46 | 7.41 | -44.31 | 3 | 3 | 1 | 45 | 323.258 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 6.35 | -6.09 | 2 | 3 | 0 | 41 | 322.25 | 4 | ↓ |