In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 32 | Yes |
Popular Name: (2S)-2-[[(1R)-2-benzyl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-ethyl-butanamide (2S)-2-[[(1R)-2-benzyl-1-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) | 5.29 | 12.85 | -13.18 | 1 | 4 | 0 | 42 | 428.576 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.29 | 14.66 | -42.85 | 2 | 4 | 1 | 43 | 429.584 | 8 | ↓ |