In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2007 | 30 | Yes |
Popular Name: N-(4-methylsulfanylbenzothiazol-2-yl)-3-phenylsulfanyl-N-(3-pyridylmethyl)propanamide N-(4-methylsulfanylbenzothiazol-…
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) | 4.13 | -0.77 | -21.45 | 0 | 4 | 0 | 46 | 451.642 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.13 | -0.66 | -52.27 | 1 | 4 | 1 | 47 | 452.65 | 8 | ↓ |