In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 22 | No |
Popular Name: 3-[(3-methyl-5-oxo-thiazolo[3,2-a]pyrimidin-7-yl)methylsulfanylmethyl]benzonitrile 3-[(3-methyl-5-oxo-thiazolo[3,2-…
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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) | 3.07 | 10.74 | -38.7 | 1 | 4 | 1 | 59 | 328.442 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.07 | 10.33 | -14.83 | 0 | 4 | 0 | 58 | 327.434 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.