In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 20 | Yes |
Popular Name: N-[(1R)-1-[2-(4-methyl-1,4-diazepan-1-yl)phenyl]ethyl]propan-1-amine N-[(1R)-1-[2-(4-methyl-1,4-diaze…
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) | 3.15 | 10.47 | -86.67 | 3 | 3 | 2 | 24 | 277.456 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.15 | 8.49 | -37.51 | 2 | 3 | 1 | 23 | 276.448 | 5 | ↓ |