In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2007 | 29 | No |
Popular Name: N-(5-bromo-2-oxo-1-prop-2-ynyl-indolin-3-ylidene)amino-3-hydroxy-naphthalene-2-carboxamide N-(5-bromo-2-oxo-1-prop-2-ynyl-i…
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) | 4.99 | 9.53 | -15.39 | 2 | 6 | 0 | 84 | 448.276 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.99 | 10.52 | -64.47 | 1 | 6 | -1 | 87 | 447.268 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.99 | 10.36 | -68.78 | 1 | 6 | -1 | 87 | 447.268 | 3 | ↓ |