In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 18 | Yes |
Popular Name: (1S)-1-(2-methoxyphenyl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamine (1S)-1-(2-methoxyphenyl)-N-[(1-m…
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) | 2.69 | 7.96 | -38.78 | 2 | 3 | 1 | 31 | 245.346 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.69 | 6.67 | -5.67 | 1 | 3 | 0 | 26 | 244.338 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.