In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 31 | Yes |
Popular Name: 3-[[6-(3-bromoanilino)pyrimidin-4-yl]amino]-N-(4-pyridylmethyl)benzamide 3-[[6-(3-bromoanilino)pyrimidin-…
None
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) | 4.53 | 11.61 | -12.42 | 3 | 7 | 0 | 92 | 475.35 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.53 | 12.07 | -46.53 | 4 | 7 | 1 | 93 | 476.358 | 7 | ↓ |