In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 19 | No |
Popular Name: 4-[2-[ethyl-[(1S)-1-methylpropyl]amino]ethoxy]benzenecarbothioamide 4-[2-[ethyl-[(1S)-1-methylpropyl…
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) | 3.41 | 7.83 | -44.16 | 3 | 3 | 1 | 40 | 281.445 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.41 | 6.05 | -11.67 | 2 | 3 | 0 | 38 | 280.437 | 8 | ↓ |