In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 17 | Yes |
Popular Name: (11R)-7-chloro-3,4,8,9,10,11-hexahydro-2H-benzo[g][1,5]benzodioxepin-11-amine (11R)-7-chloro-3,4,8,9,10,11-hex…
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) | 0.77 | 5.09 | -44.94 | 3 | 3 | 1 | 46 | 254.737 | 0 | ↓ |
Hi High (pH 8-9.5) | 0.77 | 4.85 | -4.66 | 2 | 3 | 0 | 44 | 253.729 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.