In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2009 | 25 | Yes |
Popular Name: (2S)-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-methyl-2-[(2-phenylacetyl)amino]butanamide (2S)-N-(5-isopropyl-1,3,4-thiadi…
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) | 2.62 | 7.57 | -17.07 | 2 | 6 | 0 | 84 | 360.483 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 6.49 | -43.92 | 1 | 6 | -1 | 90 | 359.475 | 7 | ↓ |