In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 33 | No |
Popular Name: [2-[(E)-3-[[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxo-prop-1-enyl]phenyl] [2-[(E)-3-[[5-(4-methoxyphenyl)-…
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) | 5.80 | 12.53 | -23.72 | 1 | 7 | 0 | 90 | 457.511 | 8 | ↓ |
Hi High (pH 8-9.5) | 5.99 | 10.67 | -59.71 | 0 | 7 | -1 | 97 | 456.503 | 8 | ↓ |