In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 25 | Yes |
Popular Name: (2S)-1-[[(1S)-2-(1H-indol-3-yl)-1-methyl-ethyl]amino]-3-(2-methylphenoxy)propan-2-ol (2S)-1-[[(1S)-2-(1H-indol-3-yl)-…
None
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) | 3.82 | 7.7 | -44.76 | 4 | 4 | 1 | 62 | 339.459 | 8 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4806655 | IBM Patent Data |