| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 24th, 2013 | 16 | Yes |
Popular Name: 2-METHOXY-4-[(METHYLSULFONYL)AMINO]BENZOIC ACID 2-METHOXY-4-[(METHYLSULFONYL)AMI…
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CAS Number: 89469-44-3
| 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) | 1.15 | 1.9 | -109.1 | 0 | 6 | -2 | 98 | 243.24 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.15 | 1.74 | -56.81 | 1 | 6 | -1 | 96 | 244.248 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.