In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 22 | Yes |
Popular Name: N-[(2S)-2-(3-chlorophenyl)-2-(dimethylamino)ethyl]-5-methyl-thiophene-2-sulfonamide N-[(2S)-2-(3-chlorophenyl)-2-(di…
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) | 3.44 | 6.69 | -49.74 | 2 | 4 | 1 | 51 | 359.924 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.44 | 4.26 | -9.85 | 1 | 4 | 0 | 49 | 358.916 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.