| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 18 | No |
Popular Name: 2-(cyclopentylmethylsulfanyl)-1-(4-nitro-1H-pyrrol-2-yl)ethanone 2-(cyclopentylmethylsulfanyl)-1-…
| 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) | 2.81 | 7.93 | -29.53 | 0 | 5 | -1 | 77 | 267.33 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.81 | 8.38 | -16.2 | 1 | 5 | 0 | 79 | 268.338 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
