| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 32 | No |
Popular Name: (2S,5S)-4-amino-1-(benzenesulfonyl)-5-benzoyl-2-(p-tolyl)-2,5-dihydropyrrole-3-carbonitrile (2S,5S)-4-amino-1-(benzenesulfon…
| 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) | 4.04 | 10.71 | -20.88 | 2 | 6 | 0 | 104 | 443.528 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.04 | 10.61 | -66.31 | 3 | 6 | 1 | 106 | 444.536 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
