In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 16 | Yes |
Popular Name: N-[(3S)-1-cyclopropylpyrrolidin-3-yl]hexane-1,6-diamine N-[(3S)-1-cyclopropylpyrrolidin-…
None
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) | 0.97 | 4.56 | -78.78 | 5 | 3 | 2 | 44 | 227.396 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.97 | 2.18 | -40.85 | 4 | 3 | 1 | 43 | 226.388 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.97 | 5.76 | -168.56 | 6 | 3 | 3 | 49 | 228.404 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.97 | 3.36 | -92.06 | 5 | 3 | 2 | 47 | 227.396 | 8 | ↓ |