| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2010 | 18 | Yes |
Popular Name: N'-cyclopropyl-N-(3-methoxypropyl)-N'-(3-thienylmethyl)ethane-1,2-diamine N'-cyclopropyl-N-(3-methoxypropy…
| 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) | 1.38 | 5.03 | -41.78 | 2 | 3 | 1 | 29 | 269.434 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.38 | 3.69 | -3.22 | 1 | 3 | 0 | 24 | 268.426 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.38 | 5.91 | -34.94 | 2 | 3 | 1 | 26 | 269.434 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | 7.27 | -121.01 | 3 | 3 | 2 | 30 | 270.442 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
