| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 15 | No |
Popular Name: 4-Amino-6-(4-chlorophenyl)-1,6-dihydro-1,3,5-triazine-2-thiol 4-Amino-6-(4-chlorophenyl)-1,6-d…
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CAS Number: 1142207-42-8
| 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) | 1.72 | 6.25 | -48.52 | 5 | 4 | 1 | 64 | 241.727 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 6.01 | -50.94 | 5 | 4 | 1 | 62 | 241.727 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 6.07 | -12.49 | 4 | 4 | 0 | 60 | 240.719 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 6.07 | -12.09 | 4 | 4 | 0 | 60 | 240.719 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
