In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2011 | 18 | Yes |
Popular Name: 3-isobutyl-1-methyl-5-[(3S)-3-propylpyrrolidin-3-yl]-1,2,4-triazole 3-isobutyl-1-methyl-5-[(3S)-3-pr…
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) | 2.37 | 6.48 | -49.75 | 2 | 4 | 1 | 47 | 251.398 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.