In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 31 | Yes |
Popular Name: 2-(azepan-1-ylmethyl)-1-[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]ethyl]benzimidazole 2-(azepan-1-ylmethyl)-1-[2-[2-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) | 5.19 | 14.71 | -40.52 | 1 | 5 | 1 | 41 | 420.577 | 8 | ↓ |
Hi High (pH 8-9.5) | 5.19 | 13.24 | -8.57 | 0 | 5 | 0 | 40 | 419.569 | 8 | ↓ |