In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 15 | Yes |
Popular Name: (2R)-2-amino-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide (2R)-2-amino-N-(4,5,6,7-tetrahyd…
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) | 0.62 | 2.76 | -48.59 | 4 | 4 | 1 | 70 | 226.325 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.54 | 1.3 | -7.7 | 3 | 4 | 0 | 71 | 225.317 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.80 | 1.14 | -42.29 | 3 | 4 | 0 | 76 | 225.317 | 2 | ↓ |