In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 21 | Yes |
Popular Name: N-(6-amino-1,3-benzothiazol-2-yl)-2-[[(2R)-2-cyanopropyl]-methyl-amino]acetamide N-(6-amino-1,3-benzothiazol-2-yl…
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) | 1.65 | 3.58 | -22.57 | 3 | 6 | 0 | 95 | 303.391 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.65 | 5.59 | -59.01 | 4 | 6 | 1 | 96 | 304.399 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 4.8 | -51.8 | 3 | 6 | 0 | 103 | 303.391 | 5 | ↓ |