In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2009 | 32 | No |
Popular Name: 3-[[(Z)-2-cyano-3-[5-(2-methoxy-4-nitro-phenyl)-2-furyl]prop-2-enoyl]amino]benzoic 3-[[(Z)-2-cyano-3-[5-(2-methoxy-…
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) | 4.02 | 11.8 | -57.68 | 1 | 10 | -1 | 161 | 432.368 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.20 | 9.91 | -115.98 | 0 | 10 | -2 | 168 | 431.36 | 7 | ↓ |