In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2011 | 13 | Yes |
Popular Name: 9-bromo-7-methyl-2,3,4,5-tetrahydro-1,5-benzoxazepine 9-bromo-7-methyl-2,3,4,5-tetrahy…
None
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) | 3.10 | 4.61 | -4.17 | 1 | 2 | 0 | 21 | 242.116 | 0 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 5.01 | -38.42 | 2 | 2 | 1 | 26 | 243.124 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.