In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-2,4,4-trimethyl-pentan-2-amine N-[(1S)-1-(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) | 5.00 | 9.44 | -31.27 | 2 | 2 | 1 | 29 | 291.484 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.00 | 7.91 | -4.79 | 1 | 2 | 0 | 25 | 290.476 | 5 | ↓ |