In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2011 | 26 | Yes |
Popular Name: 2-[benzyl(4-methoxybutyl)amino]-1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone 2-[benzyl(4-methoxybutyl)amino]-…
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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 | 11.27 | -45.33 | 1 | 4 | 1 | 34 | 373.542 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.88 | 8.71 | -8.46 | 0 | 4 | 0 | 33 | 372.534 | 9 | ↓ |