In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 13 | Yes |
Popular Name: (1R)-1-cyclopropyl-N-methyl-N-[(2S)-2-methylbutyl]ethane-1,2-diamine (1R)-1-cyclopropyl-N-methyl-N-[(…
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) | 1.63 | 3.77 | -40.95 | 3 | 2 | 1 | 31 | 185.335 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 5.39 | -118.05 | 4 | 2 | 2 | 32 | 186.343 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 5.01 | -29.21 | 3 | 2 | 1 | 30 | 185.335 | 6 | ↓ |