In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2006 | 14 | Yes |
Popular Name: [1-methyl-2-(7-methyl-1H-indol-3-yl)ethyl]amine hydrochloride [1-methyl-2-(7-methyl-1H-indol-3…
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CAS Number: 1013-47-4
1-(7-methyl-1H-indol-3-yl)propan-2-amine hydrochloride
1-Methyl-2-(7-methyl-1H-indol-3-yl)-ethylamine
1-Methyl-2-(7-methyl-1H-indol-3-yl)-ethylamine hydrochloride
1-Methyl-2-(7-methyl-1H-indol-3-yl)-ethylaminehydrochloride
1H-indole-3-ethanamine, alpha,7-dimethyl-, hydrochloride
1H-indole-3-ethanamine, alpha,7-dimethyl-, monohydrochloride
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) | 1.87 | 4.74 | -38.25 | 4 | 2 | 1 | 43 | 189.282 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0146787A2; US4616011 | IBM Patent Data |
Warnings | IRRITANT | Matrix Scientific |