In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 16 | Yes |
Popular Name: (1R)-N-ethyl-N-[(1R)-2-methoxy-1-methyl-ethyl]-1-(3-thienyl)ethane-1,2-diamine (1R)-N-ethyl-N-[(1R)-2-methoxy-1…
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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) | 1.01 | 4.22 | -119.99 | 4 | 3 | 2 | 41 | 244.404 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.01 | 3.33 | -2.07 | 2 | 3 | 0 | 38 | 242.388 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.01 | 4.69 | -27.42 | 3 | 3 | 1 | 40 | 243.396 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.01 | 2.89 | -38 | 3 | 3 | 1 | 40 | 243.396 | 7 | ↓ |