In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2011 | 21 | Yes |
Popular Name: (4R,5S)-4-amino-1-tert-butyl-5-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-2-one (4R,5S)-4-amino-1-tert-butyl-5-(…
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) | 0.93 | 4.23 | -59.16 | 3 | 5 | 1 | 66 | 291.371 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.93 | 3.42 | -8.97 | 2 | 5 | 0 | 65 | 290.363 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.