In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 18 | Yes |
Popular Name: (1R)-1-cyclopropyl-1-(4,5-dihydro-1H-thieno[3,2-e]benzimidazol-2-yl)ethanamine (1R)-1-cyclopropyl-1-(4,5-dihydr…
None
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) | 2.67 | 5.33 | -45.55 | 4 | 3 | 1 | 56 | 260.386 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.67 | 5.07 | -8.68 | 3 | 3 | 0 | 55 | 259.378 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 5.41 | -24.63 | 4 | 3 | 1 | 56 | 260.386 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 5.69 | -107.33 | 5 | 3 | 2 | 58 | 261.394 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.