| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 20th, 2010 | 27 | No |
Popular Name: 1-[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]-3-(3-pyridylmethyl)thiourea 1-[4-[(5-methylisoxazol-3-yl)sul…
| 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) | 1.11 | 5.12 | -62.09 | 2 | 8 | -1 | 111 | 402.481 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.11 | 5.12 | -23.55 | 3 | 8 | 0 | 109 | 403.489 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.11 | 5.59 | -58.12 | 4 | 8 | 1 | 110 | 404.497 | 8 | ↓ |
