| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 6th, 2011 | 23 | No |
Popular Name: 1-[(E)-indan-1-ylideneamino]-3-(2-nitrophenyl)thiourea 1-[(E)-indan-1-ylideneamino]-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) | 3.71 | 10.65 | -49.58 | 1 | 6 | -1 | 83 | 325.373 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.71 | 10.85 | -13.9 | 2 | 6 | 0 | 84 | 326.381 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.71 | 10.77 | -13.07 | 2 | 6 | 0 | 84 | 326.381 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
