In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 21 | Yes |
Popular Name: (2S,4S)-4-amino-N,N-diethyl-1-(4-methyl-1H-imidazole-2-carbonyl)pyrrolidine-2-carboxamide (2S,4S)-4-amino-N,N-diethyl-1-(4…
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) | -1.22 | 3.07 | -63.06 | 4 | 7 | 1 | 97 | 294.379 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.22 | 2.78 | -16.37 | 3 | 7 | 0 | 95 | 293.371 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.