In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2010 | 21 | Yes |
Popular Name: 3-amino-N-[[(8S)-8-bicyclo[4.2.0]octa-1(6),2,4-trienyl]methyl]-4-hydroxy-benzenesulfonamide 3-amino-N-[[(8S)-8-bicyclo[4.2.0…
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) | 1.79 | 0.94 | -13.28 | 4 | 5 | 0 | 92 | 304.371 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.79 | 1.71 | -44.08 | 3 | 5 | -1 | 95 | 303.363 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.