In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2011 | 21 | Yes |
Popular Name: N-[(2R)-2-(4-ethylpiperazin-1-yl)propyl]-1,3-benzothiazol-2-amine N-[(2R)-2-(4-ethylpiperazin-1-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) | 2.98 | 7.18 | -37.95 | 2 | 4 | 1 | 33 | 305.471 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.98 | 4.91 | -6.09 | 1 | 4 | 0 | 31 | 304.463 | 5 | ↓ |