In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 21 | Yes |
Popular Name: (3S)-3-benzyl-7-propoxy-1,2,3,4-tetrahydroisoquinoline (3S)-3-benzyl-7-propoxy-1,2,3,4-…
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) | 4.19 | 10.13 | -40.42 | 2 | 2 | 1 | 26 | 282.407 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.19 | 8.83 | -4.45 | 1 | 2 | 0 | 21 | 281.399 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.