In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 10th, 2006 | 23 | No |
Popular Name: 2-benzothiazol-2-yl-4-(cyclopropyliminomethyl)-5-propyl-1H-pyrazol-3-one 2-benzothiazol-2-yl-4-(cycloprop…
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) | 3.45 | 9.18 | -23.77 | 1 | 5 | 0 | 60 | 326.425 | 5 | ↓ |
Ref Reference (pH 7) | 3.45 | 9.21 | -26.17 | 1 | 5 | 0 | 60 | 326.425 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.51 | 7.55 | -15.77 | 1 | 5 | 0 | 63 | 326.425 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.51 | 8.1 | -19.5 | 1 | 5 | 0 | 63 | 326.425 | 5 | ↓ |