In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 17 | Yes |
Popular Name: 2-[[(1S)-1-(5-ethyl-2-thienyl)ethyl]amino]-N-isopropyl-acetamide 2-[[(1S)-1-(5-ethyl-2-thienyl)et…
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) | 3.03 | 5.88 | -40.55 | 3 | 3 | 1 | 46 | 255.407 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.03 | 4.67 | -9.15 | 2 | 3 | 0 | 41 | 254.399 | 6 | ↓ |