In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 19 | Yes |
Popular Name: (3S)-3-[[(2R)-1-ethylpyrrolidin-2-yl]methylamino]indolin-2-one (3S)-3-[[(2R)-1-ethylpyrrolidin-…
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) | 1.47 | 4.95 | -32.97 | 3 | 4 | 1 | 46 | 260.361 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 4.1 | -38.38 | 3 | 4 | 1 | 49 | 260.361 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 6.29 | -112.23 | 4 | 4 | 2 | 50 | 261.369 | 4 | ↓ |