| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 28 | No |
Popular Name: (5S)-3-benzyl-9-methylsulfanyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol (5S)-3-benzyl-9-methylsulfanyl-5…
| 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) | 4.52 | 10.19 | -41.72 | 3 | 3 | 1 | 45 | 392.544 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.52 | 9.86 | -6.75 | 2 | 3 | 0 | 44 | 391.536 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
