In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 21 | Yes |
Popular Name: [5-amino-1-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]benzimidazol-2-yl]methanol [5-amino-1-[(4S)-4,5,6,7-tetrahy…
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) | 1.98 | 4.57 | -11.51 | 3 | 4 | 0 | 64 | 299.399 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 5.27 | -26.65 | 4 | 4 | 1 | 65 | 300.407 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.