In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 25th, 2010 | 20 | Yes |
Popular Name: 4-amino-N-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]-1-propyl-pyrrole-2-carboxamide 4-amino-N-[(1S)-2-imidazol-1-yl-…
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) | 0.65 | 6.04 | -14.36 | 3 | 6 | 0 | 78 | 275.356 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.65 | 6.56 | -38.58 | 4 | 6 | 1 | 79 | 276.364 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.