In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 16 | Yes |
Popular Name: N'-[(5-bromo-2-thienyl)methyl]-N,N-diethyl-propane-1,3-diamine N'-[(5-bromo-2-thienyl)methyl]-N…
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) | 3.38 | 7.29 | -33.68 | 2 | 2 | 1 | 16 | 306.293 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.38 | 8.71 | -109.34 | 3 | 2 | 2 | 21 | 307.301 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.38 | 6.49 | -44.57 | 2 | 2 | 1 | 20 | 306.293 | 8 | ↓ |