In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2011 | 16 | Yes |
Popular Name: (1S)-1-cyclopenten-1-yl-1-(5-fluoro-2-methyl-phenyl)-N-methyl-methanamine (1S)-1-cyclopenten-1-yl-1-(5-flu…
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) | 3.35 | 8.38 | -38.88 | 2 | 1 | 1 | 17 | 220.311 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.35 | 7.16 | -2.75 | 1 | 1 | 0 | 12 | 219.303 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.