In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 20 | Yes |
Popular Name: (1S)-1-[2-(1,3-benzodioxol-4-ylmethylamino)phenyl]ethanol (1S)-1-[2-(1,3-benzodioxol-4-ylm…
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) | 2.58 | 4.09 | -7.95 | 2 | 4 | 0 | 51 | 271.316 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.