In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 22 | Yes |
Popular Name: (4S)-4-(4-chloro-3-fluoro-phenyl)-3,4-dihydro-[1,3,5]triazino[1,2-a]benzimidazol-2-amine (4S)-4-(4-chloro-3-fluoro-phenyl…
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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) | 3.33 | 9.47 | -45.46 | 4 | 5 | 1 | 67 | 316.747 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 9.03 | -17.81 | 3 | 5 | 0 | 68 | 315.739 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.