| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2009 | 25 | Yes |
Popular Name: 4-[(3-chloro-2-methylphenyl)amino]-3-methyl-2-(4-methylbenzyl)-4-oxobutanoic acid 4-[(3-chloro-2-methylphenyl)amin…
None
| 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) | 4.76 | 11.61 | -60.4 | 1 | 4 | -1 | 69 | 358.845 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.76 | 9.59 | -10.83 | 2 | 4 | 0 | 66 | 359.853 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.