In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2010 | 24 | No |
Popular Name: (2R)-2-[[2-(3-chloroanilino)-2-oxo-ethyl]-methyl-amino]-N-(3-ethoxypropyl)propanamide (2R)-2-[[2-(3-chloroanilino)-2-o…
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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) | 2.23 | 5.84 | -45.2 | 3 | 6 | 1 | 72 | 356.874 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.05 | 2.68 | -46.17 | 1 | 6 | -1 | 77 | 354.858 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 3.62 | -19.41 | 2 | 6 | 0 | 71 | 355.866 | 10 | ↓ |