In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 22nd, 2011 | 30 | Yes |
Popular Name: N-[4-(azepane-1-carbonyl)phenyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide N-[4-(azepane-1-carbonyl)phenyl]…
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) | 2.88 | 8.87 | -18.38 | 2 | 6 | 0 | 79 | 423.538 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.