In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 21 | Yes |
Popular Name: N-[(1R)-1-[3-fluoro-4-(4-methyl-1,4-diazepan-1-yl)phenyl]ethyl]propan-1-amine N-[(1R)-1-[3-fluoro-4-(4-methyl-…
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) | 3.29 | 10.26 | -80 | 3 | 3 | 2 | 24 | 295.446 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.29 | 8.26 | -41.83 | 2 | 3 | 1 | 23 | 294.438 | 5 | ↓ |