In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 15th, 2005 | 26 | Yes |
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CAS Number: 861210-42-6
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) | 0.35 | -2.38 | -46.51 | 2 | 9 | 1 | 99 | 358.426 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 192 - 193 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.