In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2009 | 20 | Yes |
Popular Name: (2S)-4-[4-(2-dimethylaminoethyloxy)phenyl]-N-propyl-butan-2-amine (2S)-4-[4-(2-dimethylaminoethylo…
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) | 3.72 | 9.82 | -80.32 | 3 | 3 | 2 | 30 | 280.456 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.72 | 7.29 | -41.41 | 2 | 3 | 1 | 29 | 279.448 | 10 | ↓ |