| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 18 | Yes |
Popular Name: N'-[(S)-cyclopropyl(2-thienyl)methyl]-N-(2-methoxyethyl)-N-methyl-ethane-1,2-diamine N'-[(S)-cyclopropyl(2-thienyl)me…
| 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) | 2.46 | 6.36 | -34.42 | 2 | 3 | 1 | 26 | 269.434 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 5.16 | -36.24 | 2 | 3 | 1 | 29 | 269.434 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 4 | -3.35 | 1 | 3 | 0 | 24 | 268.426 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.46 | 7.52 | -110.51 | 3 | 3 | 2 | 30 | 270.442 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
