In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 21 | Yes |
Popular Name: (4-amino-1H-pyrazol-3-yl)-(4-benzylpiperazin-1-yl)methanone (4-amino-1H-pyrazol-3-yl)-(4-ben…
None
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) | 0.70 | 2.72 | -9.58 | 3 | 6 | 0 | 78 | 285.351 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.70 | 4.29 | -46.2 | 4 | 6 | 1 | 79 | 286.359 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.