In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | Yes |
Popular Name: (3S)-5-bromo-3-[(1-cyclopropyl-4-piperidyl)amino]indolin-2-one (3S)-5-bromo-3-[(1-cyclopropyl-4…
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) | 2.24 | 4.48 | -38.55 | 3 | 4 | 1 | 49 | 351.268 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 5.91 | -36.9 | 3 | 4 | 1 | 46 | 351.268 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 3.51 | -5.97 | 2 | 4 | 0 | 44 | 350.26 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.24 | 6.86 | -106.77 | 4 | 4 | 2 | 50 | 352.276 | 3 | ↓ |