In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2011 | 21 | Yes |
Popular Name: 4-amino-5-tert-butyl-1-ethyl-2-(2-methoxyphenyl)pyrazol-3-one 4-amino-5-tert-butyl-1-ethyl-2-(…
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) | 3.13 | 5.87 | -15.84 | 2 | 5 | 0 | 62 | 289.379 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.13 | 5.72 | -39.22 | 3 | 5 | 1 | 64 | 290.387 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.