In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 20 | Yes |
Popular Name: (2S)-N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-1-(2-thienyl)propan-2-amine (2S)-N-[(1R)-1-(1,3-benzothiazol…
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) | 4.25 | 7.66 | -7.54 | 1 | 2 | 0 | 25 | 302.468 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 8.73 | -35.54 | 2 | 2 | 1 | 29 | 303.476 | 5 | ↓ |