In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 19 | No |
Popular Name: 4-[[(3S)-1-(1-ethylpropyl)-2,5-dioxo-pyrrolidin-3-yl]amino]butanoic 4-[[(3S)-1-(1-ethylpropyl)-2,5-d…
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) | 0.42 | 6.74 | -67.64 | 2 | 6 | 0 | 94 | 270.329 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.42 | 5.47 | -49.71 | 1 | 6 | -1 | 90 | 269.321 | 8 | ↓ |