In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (1S,2S)-N-[(2-chlorophenyl)methyl]-2-imidazol-1-yl-cyclopentanamine (1S,2S)-N-[(2-chlorophenyl)methy…
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) | 2.69 | 10.37 | -99.3 | 3 | 3 | 2 | 36 | 277.799 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.69 | 8.44 | -5.74 | 1 | 3 | 0 | 30 | 275.783 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.69 | 9.63 | -43.32 | 2 | 3 | 1 | 34 | 276.791 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.