In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 29 | No |
Popular Name: 2-[(2Z,5R)-2-benzylimino-4-keto-thiazolidin-5-yl]-N-(2-methoxy-5-nitro-phenyl)acetamide 2-[(2Z,5R)-2-benzylimino-4-keto-…
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) | 2.12 | 6.5 | -15.91 | 2 | 9 | 0 | 126 | 414.443 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 5.45 | -50.1 | 1 | 9 | -1 | 128 | 413.435 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.