In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2008 | 24 | No |
Popular Name: (3Z)-3-[2-[(3-hydroxyphenyl)amino]-4-oxo-thiazol-5-ylidene]indolin-2-one (3Z)-3-[2-[(3-hydroxyphenyl)amin…
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) | 3.42 | 2.85 | -43.03 | 2 | 6 | -1 | 97 | 336.352 | 2 | ↓ |
Ref Reference (pH 7) | 3.91 | 2.91 | -10.19 | 3 | 6 | 0 | 98 | 337.36 | 1 | ↓ |
Hi High (pH 8-9.5) | 4.82 | -0.85 | -107.91 | 1 | 6 | -2 | 104 | 335.344 | 1 | ↓ |
Hi High (pH 8-9.5) | 4.82 | -0.16 | -105.87 | 1 | 6 | -2 | 104 | 335.344 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.36 | 1.38 | -44.95 | 2 | 6 | -1 | 101 | 336.352 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.87 | 0.91 | -104.37 | 1 | 6 | -2 | 100 | 335.344 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.36 | 0.96 | -44.68 | 2 | 6 | -1 | 101 | 336.352 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.36 | 1.11 | -46.82 | 2 | 6 | -1 | 101 | 336.352 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.36 | 1.8 | -44.51 | 2 | 6 | -1 | 101 | 336.352 | 1 | ↓ |