In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 30 | Yes |
Popular Name: [2-[[(3-chlorobenzyl)-(4-fluorobenzyl)amino]methyl]thiazol-4-yl]-pyrrolidino-methanone [2-[[(3-chlorobenzyl)-(4-fluorob…
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) | 4.10 | 10.61 | -11.95 | 0 | 4 | 0 | 36 | 443.975 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.10 | 12.83 | -55.69 | 1 | 4 | 1 | 38 | 444.983 | 7 | ↓ |