In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2009 | 27 | Yes |
Popular Name: 3,4-dichloro-N-[(1R)-1-methyl-2-oxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]ethyl]benzamide 3,4-dichloro-N-[(1R)-1-methyl-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) | 4.18 | 7.98 | -16.68 | 2 | 6 | 0 | 84 | 421.309 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.37 | 6.32 | -43.08 | 1 | 6 | -1 | 90 | 420.301 | 5 | ↓ |