In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 25 | Yes |
Popular Name: (4S)-4-(4-phenyl-2-thienyl)-3,4-dihydro-[1,3,5]triazino[1,2-a]benzimidazol-2-amine (4S)-4-(4-phenyl-2-thienyl)-3,4-…
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) | 4.05 | 12.04 | -18.56 | 3 | 5 | 0 | 68 | 345.431 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.05 | 12.54 | -38.93 | 4 | 5 | 1 | 70 | 346.439 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.