In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 25th, 2011 | 26 | Yes |
Popular Name: (2S,6E)-6-amino-2-benzyl-3,5,7,16-tetrazacyclohexadec-6-ene-1,4-dione (2S,6E)-6-amino-2-benzyl-3,5,7,1…
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) | 2.39 | 5.87 | -8.38 | 5 | 7 | 0 | 109 | 359.474 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 6.75 | -40.1 | 6 | 7 | 1 | 110 | 360.482 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.