In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2009 | 22 | Yes |
Popular Name: 4-bromo-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]benzamide 4-bromo-N-[2-(3,4-dihydro-1H-iso…
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) | 3.36 | 9.53 | -49.41 | 2 | 3 | 1 | 34 | 360.275 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.36 | 7.26 | -9.64 | 1 | 3 | 0 | 32 | 359.267 | 4 | ↓ |