In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 19 | No |
Popular Name: 2-[(R)-[(3S)-3-hydroxy-5-methyl-3H-pyrazol-4-yl]-phenyl-methyl]propanedinitrile 2-[(R)-[(3S)-3-hydroxy-5-methyl-…
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) | 2.34 | 0.79 | -11.02 | 1 | 5 | 0 | 93 | 252.277 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.