In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 26th, 2011 | 24 | Yes |
Popular Name: 7-[[benzyl-[(1R)-1-methylpropyl]amino]methyl]-3-methyl-thiazolo[3,2-a]pyrimidin-5-one 7-[[benzyl-[(1R)-1-methylpropyl]…
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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) | 3.66 | 10.11 | -32.74 | 1 | 4 | 1 | 39 | 342.488 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.66 | 9.69 | -9.77 | 0 | 4 | 0 | 38 | 341.48 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.