In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2010 | 16 | No |
Popular Name: N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine N-[(1S)-1-(2,4-dimethylthiazol-5…
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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) | 1.73 | 4.98 | -28.13 | 2 | 3 | 1 | 39 | 256.42 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.73 | 5.23 | -29.62 | 2 | 3 | 1 | 39 | 256.42 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.73 | 4.74 | -5.87 | 1 | 3 | 0 | 37 | 255.412 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.