In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 24 | Yes |
Popular Name: 3-[7-(3-chlorophenyl)-9-hydroxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propanoic 3-[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) | 3.03 | 8.63 | -47.66 | 2 | 5 | 0 | 74 | 347.798 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.03 | 6.54 | -47.64 | 1 | 5 | -1 | 73 | 346.79 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.