In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2005 | 21 | No |
Popular Name: 1-(3,4-dimethylphenyl)-3-[(2-hydroxyphenyl)methyleneamino]thiourea 1-(3,4-dimethylphenyl)-3-[(2-hyd…
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) | 4.08 | 7.61 | -11.86 | 3 | 4 | 0 | 57 | 299.399 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.08 | 8.37 | -42.2 | 2 | 4 | -1 | 59 | 298.391 | 5 | ↓ |