In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 19 | Yes |
Popular Name: N-isopropyl-N-methyl-N'-thieno[3,2-c]pyridin-4-yl-butane-1,4-diamine N-isopropyl-N-methyl-N'-thieno[3…
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) | 3.04 | 9.32 | -81.81 | 3 | 3 | 2 | 31 | 279.453 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.04 | 8.96 | -37.52 | 2 | 3 | 1 | 29 | 278.445 | 7 | ↓ |