In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 30 | Yes |
Popular Name: (2R)-2-(3-tert-butylphenoxy)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)propanamide (2R)-2-(3-tert-butylphenoxy)-N-(…
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) | 4.23 | 11.47 | -30.39 | 1 | 6 | 0 | 65 | 407.514 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.42 | 10.23 | -76.72 | 0 | 6 | -1 | 72 | 406.506 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.