| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 15 | Yes |
Popular Name: 1,3-Propanediamine, N-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]-N,N-dimethyl- (9CI) 1,3-Propanediamine, N-[[(2S)-1-e…
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CAS Number: 546114-78-7
| 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) | 0.84 | 5.68 | -76.86 | 3 | 3 | 2 | 21 | 215.385 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.84 | 6.97 | -185.93 | 4 | 3 | 3 | 25 | 216.393 | 7 | ↓ |
