In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2007 | 30 | No |
Popular Name: 2-(3H-benzothiazol-2-ylidene)-4-(methyl-oxo-BLAHyl)sulfanyl-3-oxo-butanenitrile 2-(3H-benzothiazol-2-ylidene)-4-…
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 | -0.95 | -15.05 | 1 | 6 | 0 | 91 | 452.586 | 4 | ↓ |