In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 20 | Yes |
Popular Name: (1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N,N-diethyl-propane-1,3-diamine (1R)-1-(3,4-dihydro-2H-1,5-benzo…
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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) | 0.26 | 6.33 | -39.33 | 3 | 4 | 1 | 49 | 279.404 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.26 | 6.65 | -124.48 | 4 | 4 | 2 | 51 | 280.412 | 6 | ↓ |