In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 20 | Yes |
Popular Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanone 1-(3,4-dihydro-2H-1,5-benzothiaz…
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) | 2.82 | 7.57 | -10.64 | 0 | 4 | 0 | 46 | 323.468 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.