In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 20 | Yes |
Popular Name: 2-({5-[(2-morpholinoacetyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetic acid 2-({5-[(2-morpholinoacetyl)amino…
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CAS Number: 294853-34-2
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) | 0.04 | 1.77 | -53.12 | 1 | 8 | -1 | 107 | 317.372 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.14 | 0.78 | -95.08 | 0 | 8 | -2 | 114 | 316.364 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.14 | 3.1 | -82.42 | 1 | 8 | -1 | 115 | 317.372 | 6 | ↓ |