In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2010 | 31 | Yes |
Popular Name: 4-(azepan-1-ylsulfonyl)-N-[2-(8-quinolyl)ethyl]benzamide 4-(azepan-1-ylsulfonyl)-N-[2-(8-…
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) | 3.62 | 8.83 | -17.9 | 1 | 6 | 0 | 79 | 437.565 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.62 | 9.19 | -45.57 | 2 | 6 | 1 | 81 | 438.573 | 6 | ↓ |