In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 30 | Yes |
Popular Name: (4S)-5-(3-imidazol-1-ylpropyl)-3-phenyl-4-(p-tolyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one (4S)-5-(3-imidazol-1-ylpropyl)-3…
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) | 3.41 | 14.13 | -42.25 | 2 | 6 | 1 | 68 | 398.49 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.41 | 13.62 | -18.14 | 1 | 6 | 0 | 67 | 397.482 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.