In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 16 | Yes |
Popular Name: N-cyclopentyl-N'-[2-[(2S)-tetrahydrofuran-2-yl]ethyl]ethane-1,2-diamine N-cyclopentyl-N'-[2-[(2S)-tetrah…
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) | 1.21 | 5.32 | -115.84 | 4 | 3 | 2 | 42 | 228.38 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.21 | 4.2 | -37.25 | 3 | 3 | 1 | 38 | 227.372 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 3.96 | -35.76 | 3 | 3 | 1 | 38 | 227.372 | 7 | ↓ |