In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2007 | 32 | Yes |
Popular Name: 3-isopropylsulfonyl-N-(4-methylbenzothiazol-2-yl)-N-(3-pyridylmethyl)benzamide 3-isopropylsulfonyl-N-(4-methylb…
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) | 3.78 | -3.13 | -24.62 | 0 | 6 | 0 | 80 | 465.6 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.78 | -3.02 | -64.92 | 1 | 6 | 1 | 81 | 466.608 | 6 | ↓ |