In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 22 | Yes |
Popular Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-1-pyrindan-3-carbonitrile 2-[[2-(4-chlorophenyl)-2-keto-et…
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) | 4.04 | 1.33 | -11.24 | 0 | 3 | 0 | 53 | 328.824 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.04 | 1.43 | -46.47 | 1 | 3 | 1 | 55 | 329.832 | 4 | ↓ |