In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 21 | Yes |
Popular Name: 4-chloro-5-(4-cyclopropylpiperazin-1-yl)sulfonyl-2-fluoro-aniline 4-chloro-5-(4-cyclopropylpiperaz…
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) | 1.69 | 1.66 | -7.03 | 2 | 5 | 0 | 67 | 333.816 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 3.86 | -40.71 | 3 | 5 | 1 | 68 | 334.824 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.