In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2004 | 20 | Yes |
Popular Name: 2-({5-[(3,5-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl}thio)propanoic acid 2-({5-[(3,5-dimethylphenyl)amino…
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CAS Number: 743457-06-9
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) | 3.80 | -0.29 | -46.99 | 1 | 5 | -1 | 77 | 308.408 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 127 - 129 | Enamine Building Blocks |
MP | 127...129 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |