In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 21 | Yes |
Popular Name: 2-ethyl-1-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]benzimidazol-5-amine 2-ethyl-1-[(4S)-4,5,6,7-tetrahyd…
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) | 3.20 | 8.1 | -9.22 | 2 | 3 | 0 | 44 | 297.427 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 9.06 | -25.42 | 3 | 3 | 1 | 45 | 298.435 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.