In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 23rd, 2009 | 30 | Yes |
Popular Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[3-(4-methyl-1-piperidyl)propyl]hexanamide (2S)-2-[(1,1-dioxo-1,2-benzothia…
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) | 2.53 | 7.49 | -59.69 | 3 | 7 | 1 | 92 | 435.614 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 6.55 | -68.85 | 2 | 7 | 0 | 94 | 434.606 | 10 | ↓ |