In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 21 | Yes |
Popular Name: 1-[(2,5-dichloro-3-thienyl)sulfonyl]-2,3,4,5-tetrahydro-1,4-benzodiazepine 1-[(2,5-dichloro-3-thienyl)sulfo…
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) | 3.51 | 3.74 | -7.12 | 1 | 4 | 0 | 49 | 363.291 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.51 | 5.01 | -48.55 | 2 | 4 | 1 | 54 | 364.299 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.