In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2007 | 29 | Yes |
Popular Name: N-benzothiazol-2-yl-3-(4-chlorophenyl)sulfanyl-N-(3-pyridylmethyl)propanamide N-benzothiazol-2-yl-3-(4-chlorop…
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) | 4.42 | -0.58 | -19.14 | 0 | 4 | 0 | 46 | 439.993 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.42 | -0.47 | -51.19 | 1 | 4 | 1 | 47 | 441.001 | 7 | ↓ |