| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 17th, 2006 | 30 | No |
Popular Name: 1-(benzo[1,3]dioxol-5-ylmethyl)-3-(2-methoxy-4-methyl-phenyl)-1-(3-pyridylmethyl)thiourea 1-(benzo[1,3]dioxol-5-ylmethyl)-…
| 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) | 3.48 | 10.98 | -14.74 | 1 | 6 | 0 | 56 | 421.522 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.48 | 11.45 | -54.17 | 2 | 6 | 1 | 57 | 422.53 | 8 | ↓ |
