| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 17 | Yes |
Popular Name: 6,6-dimethyl-N~4~-(4-methylphenyl)-1,6-dihydro-1,3,5-triazine-2,4-diamine 6,6-dimethyl-N~4~-(4-methylpheny…
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CAS Number: 304693-27-4
| 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) | 0.80 | 7.57 | -25.78 | 5 | 5 | 1 | 76 | 232.311 | 2 | ↓ |
| Ref Reference (pH 7) | 0.93 | 7.43 | -5.47 | 4 | 5 | 0 | 72 | 231.303 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.80 | 6.86 | -14.07 | 4 | 5 | 0 | 78 | 231.303 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.80 | 6.6 | -13.45 | 4 | 5 | 0 | 75 | 231.303 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 6.49 | -6.44 | 4 | 5 | 0 | 72 | 231.303 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 6.49 | -6.2 | 4 | 5 | 0 | 72 | 231.303 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.80 | 7.04 | -33.24 | 5 | 5 | 1 | 76 | 232.311 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.80 | 6.55 | -14.05 | 4 | 5 | 0 | 75 | 231.303 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.93 | 7.37 | -33.6 | 5 | 5 | 1 | 74 | 232.311 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
