In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 22 | Yes |
Popular Name: N-allyl-2-(5-bromo-2,4-dioxo-pyrimidin-1-yl)-N-(2-thienylmethyl)acetamide N-allyl-2-(5-bromo-2,4-dioxo-pyr…
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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) | 1.42 | 6.49 | -16.74 | 1 | 6 | 0 | 75 | 384.255 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 3.8 | -57.34 | 0 | 6 | -1 | 78 | 383.247 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.