| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2010 | 14 | Yes |
Popular Name: (S)-1-(2-Methylbenzyl)pyrrolidin-3-aminedihydrochloride (S)-1-(2-Methylbenzyl)pyrrolidin…
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CAS Number: 169452-14-6
| 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) | 1.14 | 3.43 | -43.82 | 3 | 2 | 1 | 31 | 191.298 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.14 | 5.28 | -31.96 | 3 | 2 | 1 | 30 | 191.298 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.14 | 5.57 | -116.01 | 4 | 2 | 2 | 32 | 192.306 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
