In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 25 | No |
Popular Name: N-[(E)-[(9aS)-2,3,4,9a-tetrahydrocarbazol-1-ylidene]amino]-4-methyl-benzenesulfonamide N-[(E)-[(9aS)-2,3,4,9a-tetrahydr…
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) | 3.81 | 6.43 | -35.81 | 2 | 5 | 1 | 73 | 354.455 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.81 | 6.66 | -43.84 | 1 | 5 | 0 | 75 | 353.447 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.