In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 13 | Yes |
Popular Name: 2-(5-Methyl-benzo[b]thiophen-3-yl)-ethylamine 2-(5-Methyl-benzo[b]thiophen-3-y…
Find On: PubMed — Wikipedia — Google
CAS Number: 23730-69-0
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) | 2.24 | 5.22 | -50.42 | 3 | 1 | 1 | 28 | 192.307 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4600707; US4636493; US4764506 | IBM Patent Data |
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