In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 15 | No |
Popular Name: 2-[[(2R)-oxiran-2-yl]methyl]-1,3,4,5-tetrahydro-2-benzazepine 2-[[(2R)-oxiran-2-yl]methyl]-1,3…
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) | 2.08 | 6.46 | -36.4 | 1 | 2 | 1 | 17 | 204.293 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.08 | 4.36 | -4.88 | 0 | 2 | 0 | 16 | 203.285 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.