| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 24 | No |
Popular Name: N'-(3-aminopropyl)-N-[3-(3,4-dihydroquinolin-2-ylamino)propyl]butane-1,4-diamine N'-(3-aminopropyl)-N-[3-(3,4-dih…
None
| 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) | 0.98 | 6.71 | -258.26 | 9 | 5 | 4 | 87 | 335.54 | 12 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 5.29 | -159.59 | 8 | 5 | 3 | 82 | 334.532 | 12 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 6.33 | -172.15 | 8 | 5 | 3 | 85 | 334.532 | 12 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 6.1 | -108.05 | 7 | 5 | 2 | 84 | 333.524 | 13 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 5.14 | -98.26 | 7 | 5 | 2 | 81 | 333.524 | 13 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
