In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 25 | Yes |
Popular Name: (2S)-4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)methyl]-1-methyl-piperazine-2-carboxylic (2S)-4-[(1,5-dimethyl-3-oxo-2-ph…
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) | -1.20 | 7.52 | -49.07 | 1 | 7 | 0 | 75 | 344.415 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.