In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 4th, 2010 | 16 | Yes |
Popular Name: N-[2-(dimethylamino)ethyl]-N-(thien-2-ylmethyl)propane-1,3-diamine N-[2-(dimethylamino)ethyl]-N-(th…
1,3-propanediamine, N-[2-(dimethylamino)ethyl]-N-(2-thienylmethyl)-
N-[2-(dimethylamino)ethyl]-N-(2-thienylmethyl)propane-1,3-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) | 0.75 | 3.88 | -100.47 | 4 | 3 | 2 | 35 | 243.42 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.75 | 1.4 | -43.92 | 3 | 3 | 1 | 34 | 242.412 | 8 | ↓ |