In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 15 | Yes |
Popular Name: {1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl}methanamine {1-[(2-methyl-1,3-thiazol-4-yl)m…
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CAS Number: 1249955-95-0
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) | 0.20 | 4.06 | -99.12 | 4 | 3 | 2 | 45 | 227.377 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.20 | 1.82 | -46.74 | 3 | 3 | 1 | 44 | 226.369 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |