In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2011 | 33 | Yes |
Popular Name: 13-cyclohexyl-4-(3-pyridyl)-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic 13-cyclohexyl-4-(3-pyridyl)-6,7-…
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) | 6.15 | 14.99 | -55.87 | 0 | 5 | -1 | 67 | 437.519 | 3 | ↓ |
Lo Low (pH 4.5-6) | 6.15 | 15.44 | -82.64 | 1 | 5 | 0 | 68 | 438.527 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.