In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 10 | No |
Popular Name: 1,3,4-Thiadiazol-2(3H)-one, 5-(1-methylethyl)-, hydrazone (9CI) 1,3,4-Thiadiazol-2(3H)-one, 5-(1…
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CAS Number: 299163-87-4
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) | 0.67 | 1.77 | -10.27 | 3 | 4 | 0 | 64 | 158.23 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 1.57 | -49.06 | 4 | 4 | 1 | 65 | 159.238 | 2 | ↓ |