In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 16 | Yes |
Popular Name: 2-[methyl-[(2S)-2-methylbutyl]amino]-1-(1-methylpyrrol-3-yl)ethanone 2-[methyl-[(2S)-2-methylbutyl]am…
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) | 2.03 | 8.96 | -35.01 | 1 | 3 | 1 | 26 | 223.34 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.03 | 7.13 | -7.49 | 0 | 3 | 0 | 25 | 222.332 | 6 | ↓ |