In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 21 | Yes |
Popular Name: 3,5-dichloro-2-(4-prop-2-ynylpiperazin-1-yl)sulfonyl-aniline 3,5-dichloro-2-(4-prop-2-ynylpip…
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) | 2.00 | 2.78 | -7.74 | 2 | 5 | 0 | 67 | 348.255 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.00 | 5.06 | -44.4 | 3 | 5 | 1 | 68 | 349.263 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.