In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 17 | No |
Popular Name: (5S)-5-methyl-2-[(N'E)-N'-salicylidenehydrazino]-2-thiazolin-4-one (5S)-5-methyl-2-[(N'E)-N'-salicy…
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) | 1.99 | 2.35 | -16 | 2 | 5 | 0 | 74 | 249.295 | 3 | ↓ |
Ref Reference (pH 7) | 1.46 | 3.25 | -8.52 | 2 | 5 | 0 | 74 | 249.295 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.46 | 4.01 | -46.27 | 1 | 5 | -1 | 77 | 248.287 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.99 | 2.21 | -43.11 | 1 | 5 | -1 | 76 | 248.287 | 3 | ↓ |