In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 2008 | 38 | No |
Popular Name: (3E)-1-[(4-benzyl-1-piperidyl)methyl]-3-[4-(4-pyridylmethyl)phenyl]imino-indolin-2-one (3E)-1-[(4-benzyl-1-piperidyl)me…
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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) | 6.57 | 15.23 | -15.92 | 0 | 5 | 0 | 50 | 500.646 | 7 | ↓ |
Lo Low (pH 4.5-6) | 6.57 | 17.97 | -87.77 | 2 | 5 | 2 | 53 | 502.662 | 7 | ↓ |