In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 29 | Yes |
Popular Name: (2S)-2-(benzenesulfonamido)-3-methyl-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]butanamide (2S)-2-(benzenesulfonamido)-3-me…
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) | 3.98 | 6.79 | -21.58 | 2 | 7 | 0 | 101 | 430.555 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.16 | 5.57 | -46.03 | 1 | 7 | -1 | 107 | 429.547 | 7 | ↓ |