In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 18 | Yes |
Popular Name: (5R)-7-cyclohexyl-1,2,4,5-tetrahydro-3-benzoxepin-5-amine (5R)-7-cyclohexyl-1,2,4,5-tetrah…
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) | 1.74 | 6.81 | -38.73 | 3 | 2 | 1 | 37 | 246.374 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.74 | 6.63 | -2.32 | 2 | 2 | 0 | 35 | 245.366 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.