In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 19 | Yes |
Popular Name: (3S)-3-[[(2S)-morpholine-2-carbonyl]amino]-3-(2-thienyl)propanoic (3S)-3-[[(2S)-morpholine-2-carbo…
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) | -0.32 | 3.68 | -84.1 | 3 | 6 | 0 | 95 | 284.337 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.32 | 2.33 | -53.92 | 2 | 6 | -1 | 90 | 283.329 | 5 | ↓ |