| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2004 | 31 | No |
Popular Name: (5S)-1-(1,3-benzothiazol-2-yl)-4-benzoyl-5-(4-hydroxyphenyl)-2-keto-3-pyrrolin-3-olate (5S)-1-(1,3-benzothiazol-2-yl)-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) | 4.15 | 9.64 | -67.37 | 1 | 6 | -1 | 94 | 427.461 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.60 | -3.21 | -34.68 | 2 | 6 | 0 | 90 | 428.469 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | -2.98 | -23.64 | 1 | 6 | 0 | 87 | 428.469 | 4 | ↓ |
