In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2011 | 16 | Yes |
Popular Name: N,2-dimethyl-1-[(4S)-4-propylazepan-1-yl]propan-2-amine N,2-dimethyl-1-[(4S)-4-propylaze…
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) | 3.60 | 8.7 | -105.81 | 3 | 2 | 2 | 21 | 228.424 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.60 | 7.11 | -32.01 | 2 | 2 | 1 | 20 | 227.416 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.60 | 8.06 | -29.2 | 2 | 2 | 1 | 16 | 227.416 | 5 | ↓ |