In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2009 | 19 | Yes |
Popular Name: 2-[(3-chlorobenzothiophen-2-yl)methyl-cyclopropyl-amino]acetic 2-[(3-chlorobenzothiophen-2-yl)m…
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) | 2.25 | 10.59 | -29.52 | 1 | 3 | 0 | 45 | 295.791 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.25 | 8.66 | -48.64 | 0 | 3 | -1 | 43 | 294.783 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.