In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 31 | Yes |
Popular Name: 5-fluoro-3-[4-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]cyclohexyl]-1H-indole 5-fluoro-3-[4-[4-(2-methoxypheny…
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) | 4.05 | 14.56 | -38.47 | 2 | 4 | 1 | 33 | 422.568 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.05 | 12.73 | -6.73 | 1 | 4 | 0 | 32 | 421.56 | 4 | ↓ |