In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2004 | 30 | No |
Popular Name: (3Z)-3-(3-bromo-4-methyl-phenyl)imino-1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)oxindole (3Z)-3-(3-bromo-4-methyl-phenyl)…
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) | 5.90 | 11.88 | -12.1 | 0 | 4 | 0 | 38 | 460.375 | 3 | ↓ |
Lo Low (pH 4.5-6) | 5.90 | 14.21 | -45.85 | 1 | 4 | 1 | 39 | 461.383 | 3 | ↓ |
Lo Low (pH 4.5-6) | 5.90 | 13.91 | -48.18 | 1 | 4 | 1 | 39 | 461.383 | 3 | ↓ |