In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 19 | Yes |
Popular Name: 1-[(1S)-1-(2,5-dimethyl-3-thienyl)ethyl]benzimidazol-5-amine 1-[(1S)-1-(2,5-dimethyl-3-thieny…
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) | 2.54 | 7.96 | -9.68 | 2 | 3 | 0 | 44 | 271.389 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.54 | 8.45 | -29.46 | 3 | 3 | 1 | 45 | 272.397 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.