In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 16 | Yes |
Popular Name: (2R)-N-ethyl-2-[[(1S)-1-(5-methyl-2-thienyl)ethyl]amino]propanamide (2R)-N-ethyl-2-[[(1S)-1-(5-methy…
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) | 1.99 | 4.84 | -34.25 | 3 | 3 | 1 | 46 | 241.38 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.99 | 3.82 | -10.57 | 2 | 3 | 0 | 41 | 240.372 | 5 | ↓ |