In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2005 | 28 | No |
Popular Name: N-[1-(3-cyanopropyl)-2-oxo-indolin-3-ylidene]amino-5-tert-butyl-2H-pyrazole-3-carboxamide N-[1-(3-cyanopropyl)-2-oxo-indol…
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) | 2.70 | 7.79 | -19.8 | 2 | 8 | 0 | 116 | 378.436 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.69 | 0.05 | -23.3 | 2 | 8 | 0 | 115 | 378.436 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.70 | 7.63 | -25.8 | 2 | 8 | 0 | 116 | 378.436 | 6 | ↓ |