In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 33 | No |
Popular Name: (3Z)-1-[(4-benzylpiperazin-1-yl)methyl]-3-(3,4-dimethylphenyl)imino-indolin-2-one (3Z)-1-[(4-benzylpiperazin-1-yl)…
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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) | 5.44 | 10.5 | -13.13 | 0 | 5 | 0 | 41 | 438.575 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.44 | 10.98 | -11.28 | 0 | 5 | 0 | 41 | 438.575 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.44 | 12.75 | -48.48 | 1 | 5 | 1 | 42 | 439.583 | 5 | ↓ |