| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 14 | Yes |
Popular Name: 1-methyl-N-(2-methylcyclohexyl)pyrrolidin-3-amine 1-methyl-N-(2-methylcyclohexyl)p…
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CAS Number: 1250510-65-6
| 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) | 2.39 | 4.29 | -33.74 | 2 | 2 | 1 | 20 | 197.346 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.39 | 3.26 | -0.36 | 1 | 2 | 0 | 15 | 196.338 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 6.06 | -32.03 | 2 | 2 | 1 | 16 | 197.346 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.39 | 6.9 | -106.55 | 3 | 2 | 2 | 21 | 198.354 | 2 | ↓ |
| 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.