In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2011 | 16 | Yes |
Popular Name: (2R)-2-(methylamino)-1-[(4S)-4-propylazepan-1-yl]propan-1-one (2R)-2-(methylamino)-1-[(4S)-4-p…
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) | 2.44 | 6.37 | -37.42 | 2 | 3 | 1 | 37 | 227.372 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.44 | 5.13 | -7.42 | 1 | 3 | 0 | 32 | 226.364 | 4 | ↓ |