| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 14 | Yes |
Popular Name: 2-N,2-N-dimethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine 2-N,2-N-dimethyl-1,2,3,4-tetrahy…
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CAS Number: 1042797-88-5
| 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) | -0.05 | 5.1 | -36.73 | 3 | 2 | 1 | 30 | 191.298 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 5.43 | -126.54 | 4 | 2 | 2 | 32 | 192.306 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 3.07 | -41.27 | 3 | 2 | 1 | 31 | 191.298 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.