In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2007 | 29 | Yes |
Popular Name: N-benzothiazol-2-yl-4-isopropylsulfanyl-N-(3-pyridylmethyl)benzamide N-benzothiazol-2-yl-4-isopropyls…
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) | 4.97 | -0.18 | -16.25 | 0 | 4 | 0 | 46 | 419.575 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.97 | -0.06 | -51.12 | 1 | 4 | 1 | 47 | 420.583 | 6 | ↓ |