| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 23rd, 2006 | 16 | No |
Popular Name: 1-(4-(Bis(2-chloroethyl)amino)phenyl)ethanone 1-(4-(Bis(2-chloroethyl)amino)ph…
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CAS Number: 20805-66-7
| 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) | 3.15 | 1.46 | -8.31 | 0 | 2 | 0 | 20 | 260.164 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80578-1-O | UV4 (cluster #1 Of 1), Other | Other | 5500 | 0.46 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80578 | Z80578 | UV4 | 5500 | 0.46 | Functional ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.