In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 26 | Yes |
Popular Name: 3-[[(4S)-2-oxo-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazole-4-carbonyl]amino]benzoic 3-[[(4S)-2-oxo-3,4-dihydro-1H-py…
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) | 1.99 | 5.87 | -82.12 | 2 | 8 | -1 | 120 | 349.326 | 3 | ↓ |
Ref Reference (pH 7) | 1.99 | 6.6 | -126.75 | 1 | 8 | -2 | 122 | 348.318 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 7.9 | -76.6 | 2 | 8 | -1 | 119 | 349.326 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.99 | 6.34 | -75.67 | 3 | 8 | 0 | 121 | 350.334 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.98 | 8.38 | -74.4 | 3 | 8 | 0 | 121 | 350.334 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.