In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: 5-[(1S)-1-[[(3S)-1-isopropylpyrrolidin-3-yl]amino]ethyl]-1,3-dihydrobenzimidazol-2-one 5-[(1S)-1-[[(3S)-1-isopropylpyrr…
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) | 1.99 | 3.06 | -51.65 | 4 | 5 | 1 | 68 | 289.403 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.99 | 2.15 | -7.26 | 3 | 5 | 0 | 64 | 288.395 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.99 | 4.48 | -40.37 | 4 | 5 | 1 | 65 | 289.403 | 4 | ↓ |