| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 6th, 2011 | 22 | No |
Popular Name: 1-allyl-3-[(Z)-[2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]methyleneamino]thiourea 1-allyl-3-[(Z)-[2,5-dimethyl-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) | 2.78 | 9.43 | -17.1 | 2 | 6 | 0 | 67 | 317.418 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
