| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2009 | 14 | Yes |
Popular Name: N-butyl-N-(thien-2-ylmethyl)ethane-1,2-diamine N-butyl-N-(thien-2-ylmethyl)etha…
| 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) | 1.88 | 3.32 | -44.81 | 3 | 2 | 1 | 31 | 213.37 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 5.41 | -33.52 | 3 | 2 | 1 | 30 | 213.37 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 5.62 | -114.5 | 4 | 2 | 2 | 32 | 214.378 | 7 | ↓ |
