In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 28 | No |
Popular Name: N-[(5-bromo-2-oxo-indolin-3-ylidene)amino]-4-(morpholinomethyl)benzamide N-[(5-bromo-2-oxo-indolin-3-ylid…
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) | 2.77 | 4.19 | -17.11 | 2 | 7 | 0 | 87 | 443.301 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.23 | 2.58 | -43 | 1 | 7 | -1 | 90 | 442.293 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.23 | 2.26 | -51.87 | 1 | 7 | -1 | 90 | 442.293 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.59 | 6.55 | -86.52 | 4 | 7 | 2 | 86 | 445.317 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.77 | 6.58 | -51.07 | 3 | 7 | 1 | 88 | 444.309 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.77 | 6.44 | -57.5 | 3 | 7 | 1 | 88 | 444.309 | 4 | ↓ |