In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 11th, 2011 | 27 | Yes |
Popular Name: 2-[7-(3-chlorophenyl)-9-hydroxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-isobutyl-acetamide 2-[7-(3-chlorophenyl)-9-hydroxy-…
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) | 4.25 | 8.01 | -50.34 | 3 | 5 | 1 | 63 | 389.903 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 5.98 | -13.24 | 2 | 5 | 0 | 62 | 388.895 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.