In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2009 | 20 | No |
Popular Name: 4-[[methyl-[(3S)-1-methyl-2,5-dioxo-pyrrolidin-3-yl]amino]methyl]benzoic 4-[[methyl-[(3S)-1-methyl-2,5-di…
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) | 0.44 | 6.95 | -87.38 | 1 | 6 | 0 | 82 | 276.292 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.44 | 4.67 | -55.11 | 0 | 6 | -1 | 81 | 275.284 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.