In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 25 | Yes |
Popular Name: (3R)-3-[[(3R)-5-benzyl-3H-1,2,4-triazol-3-yl]methyl]-4,6-dimethyl-indolin-2-one (3R)-3-[[(3R)-5-benzyl-3H-1,2,4-…
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) | 3.13 | 8.72 | -11.37 | 2 | 5 | 0 | 71 | 332.407 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.13 | 8.96 | -12.38 | 2 | 5 | 0 | 71 | 332.407 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.13 | 8.97 | -12.11 | 2 | 5 | 0 | 71 | 332.407 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.