In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2004 | 30 | Yes |
Popular Name: 1-amyl-3-[(6-chloro-1,3-benzothiazol-2-yl)carbamoyl]-4-keto-quinolin-2-olate 1-amyl-3-[(6-chloro-1,3-benzothi…
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) | 4.82 | 12.1 | -54.96 | 1 | 6 | -1 | 87 | 440.932 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.89 | 10.71 | -142.34 | 0 | 6 | -2 | 93 | 439.924 | 6 | ↓ |