In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2009 | 16 | Yes |
Popular Name: N-[[(1R,4R,5R)-5-bicyclo[2.2.1]hept-2-enyl]methyl]-1-(5-bromo-2-thienyl)methanamine N-[[(1R,4R,5R)-5-bicyclo[2.2.1]h…
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) | 4.22 | 8.61 | -42.56 | 2 | 1 | 1 | 17 | 299.257 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.22 | 7.26 | -1.79 | 1 | 1 | 0 | 12 | 298.249 | 4 | ↓ |