In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 26 | Yes |
Popular Name: 2-[1-[[[2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)acetyl]amino]methyl]cyclohexyl]acetic 2-[1-[[[2-(3-oxo-5,6,7,8-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) | 1.92 | 7.8 | -52.28 | 1 | 7 | -1 | 104 | 360.434 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | 5.82 | -17.71 | 2 | 7 | 0 | 101 | 361.442 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.