In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (3S)-3-amino-4-bromo-1-(4-pyridylmethyl)indolin-2-one (3S)-3-amino-4-bromo-1-(4-pyridy…
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) | -0.47 | 4.62 | -9.72 | 2 | 4 | 0 | 59 | 318.174 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.47 | 4.93 | -41.39 | 3 | 4 | 1 | 61 | 319.182 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.47 | 5.08 | -39.79 | 3 | 4 | 1 | 60 | 319.182 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.47 | 5.39 | -86.76 | 4 | 4 | 2 | 62 | 320.19 | 2 | ↓ |