In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 25th, 2009 | 18 | Yes |
Popular Name: 4-(2-aminoethyl)-5-cyclopropyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one 4-(2-aminoethyl)-5-cyclopropyl-2…
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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) | 1.06 | 4.15 | -57.29 | 3 | 4 | 0 | 69 | 243.31 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.61 | 4.9 | -14.36 | 3 | 4 | 0 | 64 | 243.31 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.06 | 3.43 | -52.85 | 4 | 4 | 1 | 66 | 244.318 | 4 | ↓ |