In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2007 | 32 | Yes |
Popular Name: N-(4-isopropylbenzothiazol-2-yl)-3-methylsulfonyl-N-(3-pyridylmethyl)benzamide N-(4-isopropylbenzothiazol-2-yl)…
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) | 3.63 | -2.71 | -28.58 | 0 | 6 | 0 | 80 | 465.6 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.63 | -2.6 | -64.62 | 1 | 6 | 1 | 81 | 466.608 | 6 | ↓ |