In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 27 | Yes |
Popular Name: 4-[(4-hydroxyphenyl)methyl]-7-(o-tolyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol 4-[(4-hydroxyphenyl)methyl]-7-(o…
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) | 4.18 | 6.08 | -8.46 | 2 | 4 | 0 | 53 | 361.441 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.18 | 8.17 | -45.55 | 3 | 4 | 1 | 54 | 362.449 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.