In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 20 | Yes |
Popular Name: N-[(2S)-2-(azocan-1-yl)-2-phenyl-ethyl]propan-1-amine N-[(2S)-2-(azocan-1-yl)-2-phenyl…
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) | 4.16 | 10.9 | -112.91 | 3 | 2 | 2 | 21 | 276.468 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.16 | 9.6 | -39.27 | 2 | 2 | 1 | 20 | 275.46 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.