| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2009 | 18 | No |
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CAS Numbers: , 1144461-80-2
2-{[(2-aminoethyl)sulfanyl]methyl}-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 2-[[(2-aminoethyl)thio]methyl]-3,5,6,7-tetrahydro-
| 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) | 0.81 | 4.3 | -56.99 | 4 | 4 | 1 | 73 | 282.414 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.26 | 1.85 | -77.27 | 3 | 4 | 0 | 76 | 281.406 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
