In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 17 | Yes |
Popular Name: (1S)-1-cyclohexyl-N-(cyclopropylmethyl)-N-isopropyl-ethane-1,2-diamine (1S)-1-cyclohexyl-N-(cyclopropyl…
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) | 2.97 | 5.62 | -41.84 | 3 | 2 | 1 | 31 | 239.427 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 6.9 | -27.8 | 3 | 2 | 1 | 30 | 239.427 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.97 | 7.28 | -120.71 | 4 | 2 | 2 | 32 | 240.435 | 6 | ↓ |