| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2004 | 14 | Yes |
Popular Name: N1-(3-(3-AMINOPROPYLAMINO)PROPYL)BUTANE-1,4-DIAMINE HCL N1-(3-(3-AMINOPROPYLAMINO)PROPYL…
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CAS Numbers: 1255099-40-1 , 70862-11-2
1,12-diamino-4,8-diazadodecane
1,12-diamino-4,8-diazadodecane; N1-(3-(3-aminopropylamino)propyl)butane-1,4-diamine
| 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) | -2.13 | 0.14 | -265.08 | 10 | 4 | 4 | 88 | 206.378 | 11 | ↓ |
| Hi High (pH 8-9.5) | -2.13 | -1.59 | -88.12 | 8 | 4 | 2 | 82 | 204.362 | 11 | ↓ |
| Hi High (pH 8-9.5) | -2.13 | -1.58 | -99.38 | 8 | 4 | 2 | 82 | 204.362 | 11 | ↓ |
| Mid Mid (pH 6-8) | -2.13 | -1.2 | -158.26 | 9 | 4 | 3 | 84 | 205.37 | 11 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 97% | Fluorochem |
| UniProt Database Links | ACL5_ARATH | ChEBI |
