In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2010 | 20 | Yes |
Popular Name: (2R)-N-(1,3-benzothiazol-2-yl)-2-[isobutyl(methyl)amino]propanamide (2R)-N-(1,3-benzothiazol-2-yl)-2…
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) | 3.16 | 8.51 | -43.12 | 2 | 4 | 1 | 46 | 292.428 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 6.85 | -35.81 | 1 | 4 | 0 | 53 | 291.42 | 5 | ↓ |