In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2009 | 26 | Yes |
Popular Name: (2R)-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide (2R)-2-[(5-oxo-4-phenethyl-1H-1,…
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) | 2.99 | 9.33 | -15.07 | 2 | 6 | 0 | 80 | 368.462 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.45 | 8.5 | -49.81 | 1 | 6 | -1 | 83 | 367.454 | 7 | ↓ |