In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2011 | 20 | No |
Popular Name: (E)-N-(3-chloro-4-hydroxy-phenyl)-3-(4-chlorophenyl)prop-2-enamide (E)-N-(3-chloro-4-hydroxy-phenyl…
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) | 4.53 | 5.91 | -11.53 | 2 | 3 | 0 | 49 | 308.164 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.53 | 6.67 | -47.69 | 1 | 3 | -1 | 52 | 307.156 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.