In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 15 | Yes |
Popular Name: (1S)-1-(4,5-dihydro-1H-thieno[3,2-e]benzimidazol-2-yl)ethanamine (1S)-1-(4,5-dihydro-1H-thieno[3,…
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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) | -0.14 | 3.67 | -26.97 | 4 | 3 | 1 | 56 | 220.321 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.14 | 3.3 | -6.68 | 3 | 3 | 0 | 55 | 219.313 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.14 | 3.63 | -50.58 | 4 | 3 | 1 | 56 | 220.321 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.