In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2010 | 13 | Yes |
Popular Name: 1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine 1-[(2-methyl-1,3-thiazol-5-yl)me…
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CAS Number: 1250118-20-7
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) | -0.08 | 1.7 | -42.05 | 2 | 3 | 1 | 33 | 198.315 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.08 | 0.35 | -4.96 | 1 | 3 | 0 | 28 | 197.307 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 79 - 81 | Enamine Building Blocks |
MP | 79...81 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |